methyl 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]cyclopent-3-ene-1-carboxylate

Systemtic Name: methyl 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]cyclopent-3-ene-1-carboxylate Openeye Name: methyl 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]cyclopent-3-ene-1-carboxylate CAS Name: 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]-1-cyclopent-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]cyclopent-3-ene-1-carboxylate Traditional Name: 3-[3-sulfamoyl-2-[4-(trifluoromethyl)phenyl]phenyl]cyclopent-3-ene-1-carboxylic acid methyl ester Formula: C20H18F3NO4S MolecularWeight: 425.42143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=C(C1)C2=C(C(=CC=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1CC=C(C1)C2=C(C(=CC=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3NO4S/c1-28-19(25)14-6-5-13(11-14)16-3-2-4-17(29(24,26)27)18(16)12-7-9-15(10-8-12)20(21,22)23/h2-5,7-10,14H,6,11H2,1H3,(H2,24,26,27)