methyl 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)pyridin-2-yl]cyclopent-3-ene-1-carboxylate

Systemtic Name: methyl 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)pyridin-2-yl]cyclopent-3-ene-1-carboxylate Openeye Name: methyl 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)-2-pyridyl]cyclopent-3-ene-1-carboxylate CAS Name: 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1-cyclopent-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)pyridin-2-yl]cyclopent-3-ene-1-carboxylate Traditional Name: 3-(4-sulfamoylphenyl)-4-[5-(trifluoromethyl)-2-pyridyl]cyclopent-3-ene-1-carboxylic acid methyl ester Formula: C19H17F3N2O4S MolecularWeight: 426.40949

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17F3N2O4S/c1-28-18(25)12-8-15(11-2-5-14(6-3-11)29(23,26)27)16(9-12)17-7-4-13(10-24-17)19(20,21)22/h2-7,10,12H,8-9H2,1H3,(H2,23,26,27)