methyl 4-(4-methylphenyl)-5-sulfamoyl-2-(trifluoromethyl)benzoate

Systemtic Name: methyl 4-(4-methylphenyl)-5-sulfamoyl-2-(trifluoromethyl)benzoate Openeye Name: methyl 4-(p-tolyl)-5-sulfamoyl-2-(trifluoromethyl)benzoate CAS Name: 4-(4-methylphenyl)-5-sulfamoyl-2-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-5-sulfamoyl-2-(trifluoromethyl)benzoate Traditional Name: 4-(p-tolyl)-5-sulfamoyl-2-(trifluoromethyl)benzoic acid methyl ester Formula: C16H14F3NO4S MolecularWeight: 373.34687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)N)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)N)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C16H14F3NO4S/c1-9-3-5-10(6-4-9)11-7-13(16(17,18)19)12(15(21)24-2)8-14(11)25(20,22)23/h3-8H,1-2H3,(H2,20,22,23)