4-[[4-chloranyl-3-[methyl(phenyl)sulfamoyl]phenyl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[4-chloranyl-3-[methyl(phenyl)sulfamoyl]phenyl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[[4-chloro-3-[methyl(phenyl)sulfamoyl]benzoyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[[4-chloro-3-[methyl(phenyl)sulfamoyl]phenyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[4-chloro-3-[methyl(phenyl)sulfamoyl]benzoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[4-chloro-3-[methyl(phenyl)sulfamoyl]benzoyl]amino]-3-methyl-benzoic acid Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2O5S/c1-14-12-16(22(27)28)9-11-19(14)24-21(26)15-8-10-18(23)20(13-15)31(29,30)25(2)17-6-4-3-5-7-17/h3-13H,1-2H3,(H,24,26)(H,27,28)