[1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: [1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: [1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylanilino)-1-oxopropan-2-yl] 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O5S/c1-12-5-7-14(8-6-12)21-18(23)13(2)27-19(24)16-11-15(9-10-17(16)20)28(25,26)22(3)4/h5-11,13H,1-4H3,(H,21,23)