methyl 2-(2-cyano-5-methyl-cyclohexyl)sulfanylethanoate

Systemtic Name: methyl 2-(2-cyano-5-methyl-cyclohexyl)sulfanylethanoate Openeye Name: methyl 2-(2-cyano-5-methyl-cyclohexyl)sulfanylacetate CAS Name: 2-[(2-cyano-5-methylcyclohexyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-cyano-5-methylcyclohexyl)sulfanylacetate Traditional Name: 2-[(2-cyano-5-methyl-cyclohexyl)thio]acetic acid methyl ester Formula: C11H17NO2S MolecularWeight: 227.32318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)SCC(=O)OC)C#N

Isomeric SMILES

CC1CCC(C(C1)SCC(=O)OC)C#N

InChI

InChI=1S/C11H17NO2S/c1-8-3-4-9(6-12)10(5-8)15-7-11(13)14-2/h8-10H,3-5,7H2,1-2H3