dimethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-methylsulfonylphenyl)cyclopent-3-ene-1,1-dicarboxylate

Systemtic Name: dimethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-methylsulfonylphenyl)cyclopent-3-ene-1,1-dicarboxylate Openeye Name: dimethyl 3-(3-chloro-4-fluoro-phenyl)-4-(4-methylsulfonylphenyl)cyclopent-3-ene-1,1-dicarboxylate CAS Name: 3-(3-chloro-4-fluorophenyl)-4-(4-methylsulfonylphenyl)cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(3-chloro-4-fluorophenyl)-4-(4-methylsulfonylphenyl)cyclopent-3-ene-1,1-dicarboxylate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-4-(4-mesylphenyl)cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester Formula: C22H20ClFO6S MolecularWeight: 466.907003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(=C(C1)C2=CC(=C(C=C2)F)Cl)C3=CC=C(C=C3)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC(=O)C1(CC(=C(C1)C2=CC(=C(C=C2)F)Cl)C3=CC=C(C=C3)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C22H20ClFO6S/c1-29-20(25)22(21(26)30-2)11-16(13-4-7-15(8-5-13)31(3,27)28)17(12-22)14-6-9-19(24)18(23)10-14/h4-10H,11-12H2,1-3H3