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

Systemtic Name: sodium 6-azanylidene-5-[2-[4-benzamido-2-(4-methylphenyl)sulfonyl-phenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium 5-[2-[4-benzamido-2-(p-tolylsulfonyl)phenyl]hydrazino]-6-imino-4-oxo-naphthalene-2-sulfonate CAS Name: sodium 5-[[4-benzamido-2-(4-methylphenyl)sulfonylphenyl]hydrazo]-6-imino-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium 5-[2-[4-benzamido-2-(4-methylphenyl)sulfonylphenyl]hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonate Traditional Name: sodium 5-[N'-(4-benzamido-2-tosyl-phenyl)hydrazino]-6-imino-4-keto-naphthalene-2-sulfonate Formula: C30H23N4NaO7S2 MolecularWeight: 638.64599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)NNC4=C5C(=CC(=CC5=O)S(=O)(=O)[O-])C=CC4=N.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)NNC4=C5C(=CC(=CC5=O)S(=O)(=O)[O-])C=CC4=N.[Na+]

InChI

InChI=1S/C30H24N4O7S2.Na/c1-18-7-11-22(12-8-18)42(37,38)27-16-21(32-30(36)19-5-3-2-4-6-19)10-14-25(27)33-34-29-24(31)13-9-20-15-23(43(39,40)41)17-26(35)28(20)29;/h2-17,31,33-34H,1H3,(H,32,36)(H,39,40,41);/q;+1/p-1