ethyl 2-(2-cyano-5-propyl-cyclohexyl)sulfanylethanoate

Systemtic Name: ethyl 2-(2-cyano-5-propyl-cyclohexyl)sulfanylethanoate Openeye Name: ethyl 2-(2-cyano-5-propyl-cyclohexyl)sulfanylacetate CAS Name: 2-[(2-cyano-5-propylcyclohexyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-cyano-5-propylcyclohexyl)sulfanylacetate Traditional Name: 2-[(2-cyano-5-propyl-cyclohexyl)thio]acetic acid ethyl ester Formula: C14H23NO2S MolecularWeight: 269.40292

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(C(C1)SCC(=O)OCC)C#N

Isomeric SMILES

CCCC1CCC(C(C1)SCC(=O)OCC)C#N

InChI

InChI=1S/C14H23NO2S/c1-3-5-11-6-7-12(9-15)13(8-11)18-10-14(16)17-4-2/h11-13H,3-8,10H2,1-2H3