2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid

Systemtic Name: 2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid Openeye Name: 2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid CAS Name: 2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid Traditional Name: 2-methyl-5-[[4-[4-(trifluoromethyl)phenyl]phenyl]sulfamoyl]benzoic acid Formula: C21H16F3NO4S MolecularWeight: 435.41625

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16F3NO4S/c1-13-2-11-18(12-19(13)20(26)27)30(28,29)25-17-9-5-15(6-10-17)14-3-7-16(8-4-14)21(22,23)24/h2-12,25H,1H3,(H,26,27)