3-chloranyl-5,5-dimethyl-2-(phenylsulfonylmethyl)cyclohex-2-en-1-one

Systemtic Name: 3-chloranyl-5,5-dimethyl-2-(phenylsulfonylmethyl)cyclohex-2-en-1-one Openeye Name: 2-(benzenesulfonylmethyl)-3-chloro-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-(benzenesulfonylmethyl)-3-chloro-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-(benzenesulfonylmethyl)-3-chloro-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-(besylmethyl)-3-chloro-5,5-dimethyl-cyclohex-2-en-1-one Formula: C15H17ClO3S MolecularWeight: 312.81168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)CS(=O)(=O)C2=CC=CC=C2)Cl)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)CS(=O)(=O)C2=CC=CC=C2)Cl)C

InChI

InChI=1S/C15H17ClO3S/c1-15(2)8-13(16)12(14(17)9-15)10-20(18,19)11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3