2-[(4-methylphenyl)sulfonylcarbamoyl-phenyl-amino]benzoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonylcarbamoyl-phenyl-amino]benzoic acid Openeye Name: 2-[N-(p-tolylsulfonylcarbamoyl)anilino]benzoic acid CAS Name: 2-(N-[[(4-methylphenyl)sulfonylamino]-oxomethyl]anilino)benzoic acid IUPAC Name: 2-[N-[(4-methylphenyl)sulfonylcarbamoyl]anilino]benzoic acid Traditional Name: 2-[N-(tosylcarbamoyl)anilino]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)NC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3C(=O)O

InChI

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