methyl 3-(2-cyanocyclohexyl)sulfanylpropanoate

Systemtic Name: methyl 3-(2-cyanocyclohexyl)sulfanylpropanoate Openeye Name: methyl 3-(2-cyanocyclohexyl)sulfanylpropanoate CAS Name: 3-[(2-cyanocyclohexyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(2-cyanocyclohexyl)sulfanylpropanoate Traditional Name: 3-[(2-cyanocyclohexyl)thio]propionic acid methyl ester Formula: C11H17NO2S MolecularWeight: 227.32318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1CCCCC1C#N

Isomeric SMILES

COC(=O)CCSC1CCCCC1C#N

InChI

InChI=1S/C11H17NO2S/c1-14-11(13)6-7-15-10-5-3-2-4-9(10)8-12/h9-10H,2-7H2,1H3