methylsulfanylmethyl (1S,6R)-6-phenylcyclohex-3-ene-1-carboxylate

Systemtic Name: methylsulfanylmethyl (1S,6R)-6-phenylcyclohex-3-ene-1-carboxylate Openeye Name: methylsulfanylmethyl (1S,6R)-6-phenylcyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-phenyl-1-cyclohex-3-enecarboxylic acid (methylthio)methyl ester IUPAC Name: methylsulfanylmethyl (1S,6R)-6-phenylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-phenylcyclohex-3-ene-1-carboxylic acid (methylthio)methyl ester Formula: C15H18O2S MolecularWeight: 262.36722

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Descriptors Computed from Structure

Canonical SMILES:

CSCOC(=O)C1CC=CCC1C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C15H18O2S/c1-18-11-17-15(16)14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-8,13-14H,9-11H2,1H3/t13-,14-/m0/s1