disodium (6Z)-3-[(4-acetamidophenyl)diazenyl]-4-azanyl-5-oxidanylidene-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonate

Systemtic Name: disodium (6Z)-3-[(4-acetamidophenyl)diazenyl]-4-azanyl-5-oxidanylidene-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonate Openeye Name: disodium (6Z)-3-(4-acetamidophenyl)azo-4-amino-5-oxo-6-(phenylhydrazono)naphthalene-2,7-disulfonate CAS Name: disodium (6Z)-3-(4-acetamidophenyl)azo-4-amino-5-oxo-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonate IUPAC Name: disodium (6Z)-3-[(4-acetamidophenyl)diazenyl]-4-amino-5-oxo-6-(phenylhydrazinylidene)naphthalene-2,7-disulfonate Traditional Name: disodium (6Z)-3-(4-acetamidophenyl)azo-4-amino-5-keto-6-(phenylhydrazono)naphthalene-2,7-disulfonate Formula: C24H18N6Na2O8S2 MolecularWeight: 628.54466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=C3C=C(C(=NNC4=CC=CC=C4)C(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=C3C=C(/C(=N\NC4=CC=CC=C4)/C(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H20N6O8S2.2Na/c1-13(31)26-15-7-9-17(10-8-15)28-29-22-18(39(33,34)35)11-14-12-19(40(36,37)38)23(24(32)20(14)21(22)25)30-27-16-5-3-2-4-6-16;;/h2-12,27H,25H2,1H3,(H,26,31)(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b29-28?,30-23+;;