[1-(phenylsulfanylmethyl)cyclohexyl] ethanoate

Systemtic Name: [1-(phenylsulfanylmethyl)cyclohexyl] ethanoate Openeye Name: [1-(phenylsulfanylmethyl)cyclohexyl] acetate CAS Name: acetic acid [1-[(phenylthio)methyl]cyclohexyl] ester IUPAC Name: [1-(phenylsulfanylmethyl)cyclohexyl] acetate Traditional Name: acetic acid [1-[(phenylthio)methyl]cyclohexyl] ester Formula: C15H20O2S MolecularWeight: 264.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCCCC1)CSC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1(CCCCC1)CSC2=CC=CC=C2

InChI

InChI=1S/C15H20O2S/c1-13(16)17-15(10-6-3-7-11-15)12-18-14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-12H2,1H3