5-[[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[(Z)-C-phenyl-N-(p-tolylsulfonyl)carbonimidoyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[(Z)-(4-methylphenyl)sulfonylimino-phenylmethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[(Z)-N-(4-methylphenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[(Z)-C-phenyl-N-tosyl-carbonimidoyl]amino]benzoic acid Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)NC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(/C2=CC=CC=C2)\NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C21H18N2O5S/c1-14-7-10-17(11-8-14)29(27,28)23-20(15-5-3-2-4-6-15)22-16-9-12-19(24)18(13-16)21(25)26/h2-13,24H,1H3,(H,22,23)(H,25,26)