disodium 5-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-3-(phenylhydrazinylidene)naphthalene-2,7-disulfonate

Systemtic Name: disodium 5-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-3-(phenylhydrazinylidene)naphthalene-2,7-disulfonate Openeye Name: disodium 4-oxo-3-(phenylhydrazono)-5-(p-tolylsulfonylamino)naphthalene-2,7-disulfonate CAS Name: disodium 5-[(4-methylphenyl)sulfonylamino]-4-oxo-3-(phenylhydrazinylidene)naphthalene-2,7-disulfonate IUPAC Name: disodium 5-[(4-methylphenyl)sulfonylamino]-4-oxo-3-(phenylhydrazinylidene)naphthalene-2,7-disulfonate Traditional Name: disodium 4-keto-3-(phenylhydrazono)-5-(tosylamino)naphthalene-2,7-disulfonate Formula: C23H17N3Na2O9S3 MolecularWeight: 621.57032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=NNC4=CC=CC=C4)C3=O)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=NNC4=CC=CC=C4)C3=O)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C23H19N3O9S3.2Na/c1-14-7-9-17(10-8-14)36(28,29)26-19-13-18(37(30,31)32)11-15-12-20(38(33,34)35)22(23(27)21(15)19)25-24-16-5-3-2-4-6-16;;/h2-13,24,26H,1H3,(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2