(7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-20-(2-methoxy-2-oxidanylidene-ethyl)-3,8,13,17-tetramethyl-12-(1-oxidanidylethylidene)-18-[3-oxidanylidene-3-(3-oxidanylpropylamino)propyl]-8,17,18,22-tetrahydro-7H-porphyrin-2-carboximidate; palladium(2+)

Systemtic Name: (7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-20-(2-methoxy-2-oxidanylidene-ethyl)-3,8,13,17-tetramethyl-12-(1-oxidanidylethylidene)-18-[3-oxidanylidene-3-(3-oxidanylpropylamino)propyl]-8,17,18,22-tetrahydro-7H-porphyrin-2-carboximidate; palladium(2+) Openeye Name: (7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-18-[3-(3-hydroxypropylamino)-3-oxo-propyl]-20-(2-methoxy-2-oxo-ethyl)-3,8,13,17-tetramethyl-12-(1-oxidoethylidene)-8,17,18,22-tetrahydro-7H-porphyrin-2-carboximidate; palladium(2+) CAS Name: (7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-18-[3-(3-hydroxypropylamino)-3-oxopropyl]-20-(2-methoxy-2-oxoethyl)-3,8,13,17-tetramethyl-12-(1-oxidoethylidene)-8,17,18,22-tetrahydro-7H-porphyrin-2-carboximidate; palladium(2+) IUPAC Name: (7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-18-[3-(3-hydroxypropylamino)-3-oxopropyl]-20-(2-methoxy-2-oxoethyl)-3,8,13,17-tetramethyl-12-(1-oxidoethylidene)-8,17,18,22-tetrahydro-7H-porphyrin-2-carboximidate; palladium(2+) Traditional Name: (7R,8R,12E,17S,18S)-N-(2-dimethylaminoethyl)-7-ethyl-18-[3-(3-hydroxypropylamino)-3-keto-propyl]-20-(2-keto-2-methoxy-ethyl)-3,8,13,17-tetramethyl-12-(1-oxidoethylidene)-8,17,18,22-tetrahydro-7H-porphine-2-carboximidate; palladium(2+) Formula: C42H55N7O6Pd MolecularWeight: 860.3494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2=CC3=NC(=C(C3=C(C)[O-])C)C=C4C(C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=NCCN(C)C)[O-])CC(=O)OC)CCC(=O)NCCCO)C)C.[Pd+2]

Isomeric SMILES

CC[C@@H]1[C@H](C2=CC\3=NC(=C(/C3=C(/C)\[O-])C)C=C4[C@H]([C@@H](C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=NCCN(C)C)[O-])CC(=O)OC)CCC(=O)NCCCO)C)C.[Pd+2]

InChI

InChI=1S/C42H57N7O6.Pd/c1-10-27-22(2)30-21-35-38(26(6)51)24(4)32(46-35)19-31-23(3)28(12-13-36(52)43-14-11-17-50)40(47-31)29(18-37(53)55-9)41-39(42(54)44-15-16-49(7)8)25(5)33(48-41)20-34(27)45-30;/h19-23,27-28,45,50-51H,10-18H2,1-9H3,(H,43,52)(H,44,54);/q;+2/p-2/b30-21?,31-19?,34-20?,38-26+,41-29?;/t22-,23+,27-,28+;/m1./s1