2-methyl-2-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one

Systemtic Name: 2-methyl-2-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one Openeye Name: 2-methyl-2-(1-methyl-1-phenylsulfanyl-ethyl)cyclohexanone CAS Name: 2-methyl-2-[2-(phenylthio)propan-2-yl]-1-cyclohexanone IUPAC Name: 2-methyl-2-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one Traditional Name: 2-methyl-2-[1-methyl-1-(phenylthio)ethyl]cyclohexanone Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1=O)C(C)(C)SC2=CC=CC=C2

Isomeric SMILES

CC1(CCCCC1=O)C(C)(C)SC2=CC=CC=C2

InChI

InChI=1S/C16H22OS/c1-15(2,18-13-9-5-4-6-10-13)16(3)12-8-7-11-14(16)17/h4-6,9-10H,7-8,11-12H2,1-3H3