2,2-dimethyl-6-[2-(phenylsulfonyl)ethyl]cyclohexan-1-one

Systemtic Name: 2,2-dimethyl-6-[2-(phenylsulfonyl)ethyl]cyclohexan-1-one Openeye Name: 6-[2-(benzenesulfonyl)ethyl]-2,2-dimethyl-cyclohexanone CAS Name: 6-[2-(benzenesulfonyl)ethyl]-2,2-dimethyl-1-cyclohexanone IUPAC Name: 6-[2-(benzenesulfonyl)ethyl]-2,2-dimethylcyclohexan-1-one Traditional Name: 6-(2-besylethyl)-2,2-dimethyl-cyclohexanone Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1=O)CCS(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CCCC(C1=O)CCS(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H22O3S/c1-16(2)11-6-7-13(15(16)17)10-12-20(18,19)14-8-4-3-5-9-14/h3-5,8-9,13H,6-7,10-12H2,1-2H3