sodium 5-[2-[4-acetamido-2-(4-methylphenyl)sulfonyl-phenyl]hydrazinyl]-6-azanylidene-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium 5-[2-[4-acetamido-2-(4-methylphenyl)sulfonyl-phenyl]hydrazinyl]-6-azanylidene-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium 5-[2-[4-acetamido-2-(p-tolylsulfonyl)phenyl]hydrazino]-6-imino-4-oxo-naphthalene-2-sulfonate CAS Name: sodium 5-[[4-acetamido-2-(4-methylphenyl)sulfonylphenyl]hydrazo]-6-imino-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium 5-[2-[4-acetamido-2-(4-methylphenyl)sulfonylphenyl]hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonate Traditional Name: sodium 5-[N'-(4-acetamido-2-tosyl-phenyl)hydrazino]-6-imino-4-keto-naphthalene-2-sulfonate Formula: C25H21N4NaO7S2 MolecularWeight: 576.57661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]

InChI

InChI=1S/C25H22N4O7S2.Na/c1-14-3-7-18(8-4-14)37(32,33)23-12-17(27-15(2)30)6-10-21(23)28-29-25-20(26)9-5-16-11-19(38(34,35)36)13-22(31)24(16)25;/h3-13,26,28-29H,1-2H3,(H,27,30)(H,34,35,36);/q;+1/p-1