2-(4-chlorophenyl)-4-ethyl-4-methyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one

Systemtic Name: 2-(4-chlorophenyl)-4-ethyl-4-methyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one Openeye Name: 2-(4-chlorophenyl)-4-ethyl-4-methyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one CAS Name: 2-(4-chlorophenyl)-4-ethyl-4-methyl-3-(4-methylsulfonylphenyl)-1-cyclopent-2-enone IUPAC Name: 2-(4-chlorophenyl)-4-ethyl-4-methyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one Traditional Name: 2-(4-chlorophenyl)-4-ethyl-3-(4-mesylphenyl)-4-methyl-cyclopent-2-en-1-one Formula: C21H21ClO3S MolecularWeight: 388.90764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H21ClO3S/c1-4-21(2)13-18(23)19(14-5-9-16(22)10-6-14)20(21)15-7-11-17(12-8-15)26(3,24)25/h5-12H,4,13H2,1-3H3