tetrapotassium [4-[[4-[[4-[[5-[[4-[[4,6-bis[oxidanidyl(oxidanyl)phosphoryl]naphthalen-1-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]-7-[oxidanidyl(oxidanyl)phosphoryl]naphthalen-1-yl]-oxidanyl-phosphinate

Systemtic Name: tetrapotassium [4-[[4-[[4-[[5-[[4-[[4,6-bis[oxidanidyl(oxidanyl)phosphoryl]naphthalen-1-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]-7-[oxidanidyl(oxidanyl)phosphoryl]naphthalen-1-yl]-oxidanyl-phosphinate Openeye Name: tetrapotassium [4-[[4-[[4-[[5-[[4-[[4,6-bis[hydroxy(oxido)phosphoryl]-1-naphthyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]-7-[hydroxy(oxido)phosphoryl]-1-naphthyl]-hydroxy-phosphinate CAS Name: tetrapotassium [4-[[[4-[[[4-[[[[5-[[[4-[[[4,6-bis[hydroxy(oxido)phosphoryl]-1-naphthalenyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]-7-[hydroxy(oxido)phosphoryl]-1-naphthalenyl]-hydroxyphosphinate IUPAC Name: tetrapotassium [4-[[4-[[4-[[5-[[4-[[4,6-bis[hydroxy(oxido)phosphoryl]naphthalen-1-yl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]carbamoylamino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-3-carbonyl]amino]-7-[hydroxy(oxido)phosphoryl]naphthalen-1-yl]-hydroxyphosphinate Traditional Name: tetrapotassium [4-[[4-[[4-[[5-[[4-[[4,6-bis[hydroxy(oxido)phosphoryl]-1-naphthyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-3-carbonyl]amino]-7-[hydroxy(oxido)phosphoryl]-1-naphthyl]-hydroxy-phosphinate Formula: C45H40K4N10O17P4 MolecularWeight: 1273.144144

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C1)NC(=O)C2=CC(=CN2C)NC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C=C4C(=O)NC5=C6C=CC(=CC6=C(C=C5)P(=O)(O)[O-])P(=O)(O)[O-])C)C)C(=O)NC7=C8C=CC(=CC8=C(C=C7)P(=O)(O)[O-])P(=O)(O)[O-].[K+].[K+].[K+].[K+]

Isomeric SMILES

CN1C=C(C(=C1)NC(=O)C2=CC(=CN2C)NC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C=C4C(=O)NC5=C6C=CC(=CC6=C(C=C5)P(=O)(O)[O-])P(=O)(O)[O-])C)C)C(=O)NC7=C8C=CC(=CC8=C(C=C7)P(=O)(O)[O-])P(=O)(O)[O-].[K+].[K+].[K+].[K+]

InChI

InChI=1S/C45H44N10O17P4.4K/c1-52-19-31(41(56)48-33-9-11-39(75(67,68)69)29-15-25(73(61,62)63)5-7-27(29)33)35(21-52)50-43(58)37-13-23(17-54(37)3)46-45(60)47-24-14-38(55(4)18-24)44(59)51-36-22-53(2)20-32(36)42(57)49-34-10-12-40(76(70,71)72)30-16-26(74(64,65)66)6-8-28(30)34;;;;/h5-22H,1-4H3,(H,48,56)(H,49,57)(H,50,58)(H,51,59)(H2,46,47,60)(H2,61,62,63)(H2,64,65,66)(H2,67,68,69)(H2,70,71,72);;;;/q;4*+1/p-4