(1S,2S,4R)-1-methyl-2-phenylsulfanyl-4-prop-1-en-2-yl-cyclohexan-1-ol

Systemtic Name: (1S,2S,4R)-1-methyl-2-phenylsulfanyl-4-prop-1-en-2-yl-cyclohexan-1-ol Openeye Name: (1S,2S,4R)-4-isopropenyl-1-methyl-2-phenylsulfanyl-cyclohexanol CAS Name: (1S,2S,4R)-1-methyl-4-(1-methylethenyl)-2-(phenylthio)-1-cyclohexanol IUPAC Name: (1S,2S,4R)-1-methyl-2-phenylsulfanyl-4-prop-1-en-2-ylcyclohexan-1-ol Traditional Name: (1S,2S,4R)-4-isopropenyl-1-methyl-2-(phenylthio)cyclohexanol Formula: C16H22OS MolecularWeight: 262.41028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(C(C1)SC2=CC=CC=C2)(C)O

Isomeric SMILES

CC(=C)[C@@H]1CC[C@]([C@H](C1)SC2=CC=CC=C2)(C)O

InChI

InChI=1S/C16H22OS/c1-12(2)13-9-10-16(3,17)15(11-13)18-14-7-5-4-6-8-14/h4-8,13,15,17H,1,9-11H2,2-3H3/t13-,15+,16+/m1/s1