2-(1-benzothiophen-5-yloxy)-4,4-dimethyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one

Systemtic Name: 2-(1-benzothiophen-5-yloxy)-4,4-dimethyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one Openeye Name: 2-(benzothiophen-5-yloxy)-4,4-dimethyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one CAS Name: 2-(1-benzothiophen-5-yloxy)-4,4-dimethyl-3-(4-methylsulfonylphenyl)-1-cyclopent-2-enone IUPAC Name: 2-(1-benzothiophen-5-yloxy)-4,4-dimethyl-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one Traditional Name: 2-(benzothiophen-5-yloxy)-3-(4-mesylphenyl)-4,4-dimethyl-cyclopent-2-en-1-one Formula: C22H20O4S2 MolecularWeight: 412.5218

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)OC3=CC4=C(C=C3)SC=C4)C

Isomeric SMILES

CC1(CC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)OC3=CC4=C(C=C3)SC=C4)C

InChI

InChI=1S/C22H20O4S2/c1-22(2)13-18(23)21(26-16-6-9-19-15(12-16)10-11-27-19)20(22)14-4-7-17(8-5-14)28(3,24)25/h4-12H,13H2,1-3H3