2-[[3-[2-(4-methylphenyl)sulfonylhydrazinyl]-3-oxidanylidene-propanoyl]amino]benzoic acid

Systemtic Name: 2-[[3-[2-(4-methylphenyl)sulfonylhydrazinyl]-3-oxidanylidene-propanoyl]amino]benzoic acid Openeye Name: 2-[[3-oxo-3-[2-(p-tolylsulfonyl)hydrazino]propanoyl]amino]benzoic acid CAS Name: 2-[[3-[(4-methylphenyl)sulfonylhydrazo]-1,3-dioxopropyl]amino]benzoic acid IUPAC Name: 2-[[3-[2-(4-methylphenyl)sulfonylhydrazinyl]-3-oxopropanoyl]amino]benzoic acid Traditional Name: 2-[[3-keto-3-(N'-tosylhydrazino)propanoyl]amino]benzoic acid Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H17N3O6S/c1-11-6-8-12(9-7-11)27(25,26)20-19-16(22)10-15(21)18-14-5-3-2-4-13(14)17(23)24/h2-9,20H,10H2,1H3,(H,18,21)(H,19,22)(H,23,24)