(2R,3R)-2,3-dimethyl-2-(phenylsulfanylmethyl)cyclohexan-1-one

Systemtic Name: (2R,3R)-2,3-dimethyl-2-(phenylsulfanylmethyl)cyclohexan-1-one Openeye Name: (2R,3R)-2,3-dimethyl-2-(phenylsulfanylmethyl)cyclohexanone CAS Name: (2R,3R)-2,3-dimethyl-2-[(phenylthio)methyl]-1-cyclohexanone IUPAC Name: (2R,3R)-2,3-dimethyl-2-(phenylsulfanylmethyl)cyclohexan-1-one Traditional Name: (2R,3R)-2,3-dimethyl-2-[(phenylthio)methyl]cyclohexanone Formula: C15H20OS MolecularWeight: 248.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=O)C1(C)CSC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCCC(=O)[C@]1(C)CSC2=CC=CC=C2

InChI

InChI=1S/C15H20OS/c1-12-7-6-10-14(16)15(12,2)11-17-13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3/t12-,15-/m1/s1