methyl 3-(4-fluorophenyl)-4-(6-methylsulfonylpyridin-3-yl)cyclopent-3-ene-1-carboxylate

Systemtic Name: methyl 3-(4-fluorophenyl)-4-(6-methylsulfonylpyridin-3-yl)cyclopent-3-ene-1-carboxylate Openeye Name: methyl 3-(4-fluorophenyl)-4-(6-methylsulfonyl-3-pyridyl)cyclopent-3-ene-1-carboxylate CAS Name: 3-(4-fluorophenyl)-4-(6-methylsulfonyl-3-pyridinyl)-1-cyclopent-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-4-(6-methylsulfonylpyridin-3-yl)cyclopent-3-ene-1-carboxylate Traditional Name: 3-(4-fluorophenyl)-4-(6-mesyl-3-pyridyl)cyclopent-3-ene-1-carboxylic acid methyl ester Formula: C19H18FNO4S MolecularWeight: 375.413923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FNO4S/c1-25-19(22)14-9-16(12-3-6-15(20)7-4-12)17(10-14)13-5-8-18(21-11-13)26(2,23)24/h3-8,11,14H,9-10H2,1-2H3