dicopper tetrasodium 4-oxidanidyl-7-[[5-oxidanidyl-6-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]-7-sulfonato-naphthalen-2-yl]carbamoylamino]-3-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]naphthalene-2-sulfonate

Systemtic Name: dicopper tetrasodium 4-oxidanidyl-7-[[5-oxidanidyl-6-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]-7-sulfonato-naphthalen-2-yl]carbamoylamino]-3-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]naphthalene-2-sulfonate Openeye Name: dicopper tetrasodium 4-oxido-7-[[5-oxido-6-(2-oxido-5-sulfonato-phenyl)azo-7-sulfonato-2-naphthyl]carbamoylamino]-3-(2-oxido-5-sulfonato-phenyl)azo-naphthalene-2-sulfonate CAS Name: dicopper tetrasodium 4-oxido-7-[[[[5-oxido-6-(2-oxido-5-sulfonatophenyl)azo-7-sulfonato-2-naphthalenyl]amino]-oxomethyl]amino]-3-(2-oxido-5-sulfonatophenyl)azo-2-naphthalenesulfonate IUPAC Name: dicopper tetrasodium 4-oxido-7-[[5-oxido-6-[(2-oxido-5-sulfonatophenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate Traditional Name: dicupric tetrasodium 4-oxido-7-[[5-oxido-6-(2-oxido-5-sulfonato-phenyl)azo-7-sulfonato-2-naphthyl]carbamoylamino]-3-(2-oxido-5-sulfonato-phenyl)azo-naphthalene-2-sulfonate Formula: C33H16Cu2N6Na4O17S4 MolecularWeight: 1115.82122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2C=C1NC(=O)NC3=CC4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]

Isomeric SMILES

C1=CC2=C(C(=C(C=C2C=C1NC(=O)NC3=CC4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]

InChI

InChI=1S/C33H24N6O17S4.2Cu.4Na/c40-25-7-3-19(57(45,46)47)13-23(25)36-38-29-27(59(51,52)53)11-15-9-17(1-5-21(15)31(29)42)34-33(44)35-18-2-6-22-16(10-18)12-28(60(54,55)56)30(32(22)43)39-37-24-14-20(58(48,49)50)4-8-26(24)41;;;;;;/h1-14,40-43H,(H2,34,35,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;;;/q;2*+2;4*+1/p-8