6-azanylidene-5-[2-[5-chloranyl-2-(4-methylphenyl)sulfonyl-phenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: 6-azanylidene-5-[2-[5-chloranyl-2-(4-methylphenyl)sulfonyl-phenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: 5-[2-[5-chloro-2-(p-tolylsulfonyl)phenyl]hydrazino]-6-imino-4-oxo-naphthalene-2-sulfonic acid CAS Name: 5-[[5-chloro-2-(4-methylphenyl)sulfonylphenyl]hydrazo]-6-imino-4-oxo-2-naphthalenesulfonic acid IUPAC Name: 5-[2-[5-chloro-2-(4-methylphenyl)sulfonylphenyl]hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonic acid Traditional Name: 5-[N'-(5-chloro-2-tosyl-phenyl)hydrazino]-6-imino-4-keto-naphthalene-2-sulfonic acid Formula: C23H18ClN3O6S2 MolecularWeight: 531.98852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)Cl)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)O)C=CC3=N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)Cl)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)O)C=CC3=N

InChI

InChI=1S/C23H18ClN3O6S2/c1-13-2-6-16(7-3-13)34(29,30)21-9-5-15(24)11-19(21)26-27-23-18(25)8-4-14-10-17(35(31,32)33)12-20(28)22(14)23/h2-12,25-27H,1H3,(H,31,32,33)