methyl 2-(phenylmethylsulfanyl)cyclohexane-1-carboxylate

Systemtic Name: methyl 2-(phenylmethylsulfanyl)cyclohexane-1-carboxylate Openeye Name: methyl 2-benzylsulfanylcyclohexanecarboxylate CAS Name: 2-(phenylmethylthio)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 2-benzylsulfanylcyclohexane-1-carboxylate Traditional Name: 2-(benzylthio)cyclohexanecarboxylic acid methyl ester Formula: C15H20O2S MolecularWeight: 264.3831

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCC1SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CCCCC1SCC2=CC=CC=C2

InChI

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