3-[[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]sulfamoyl]-4-methyl-benzoic acid Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2O5S/c1-10-6-7-12(17(22)23)8-15(10)26(24,25)19-9-16(21)20-14-5-3-4-13(18)11(14)2/h3-8,19H,9H2,1-2H3,(H,20,21)(H,22,23)