[(1R,3S)-3-phenylsulfanylcyclohexyl] ethanoate

Systemtic Name: [(1R,3S)-3-phenylsulfanylcyclohexyl] ethanoate Openeye Name: [(1R,3S)-3-phenylsulfanylcyclohexyl] acetate CAS Name: acetic acid [(1R,3S)-3-(phenylthio)cyclohexyl] ester IUPAC Name: [(1R,3S)-3-phenylsulfanylcyclohexyl] acetate Traditional Name: acetic acid [(1R,3S)-3-(phenylthio)cyclohexyl] ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCC(C1)SC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C14H18O2S/c1-11(15)16-12-6-5-9-14(10-12)17-13-7-3-2-4-8-13/h2-4,7-8,12,14H,5-6,9-10H2,1H3/t12-,14+/m1/s1