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

Systemtic Name: 4-[[3-[(4-chlorophenyl)sulfamoyl]-4-methyl-phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[3-[(4-chlorophenyl)sulfamoyl]-4-methyl-benzoyl]amino]benzoic acid CAS Name: 4-[[[3-[(4-chlorophenyl)sulfamoyl]-4-methylphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[3-[(4-chlorophenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid Traditional Name: 4-[[3-[(4-chlorophenyl)sulfamoyl]-4-methyl-benzoyl]amino]benzoic acid Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O5S/c1-13-2-3-15(20(25)23-17-8-4-14(5-9-17)21(26)27)12-19(13)30(28,29)24-18-10-6-16(22)7-11-18/h2-12,24H,1H3,(H,23,25)(H,26,27)