ethyl 2-[(1S,2S)-1-cyano-2-methoxy-cyclohexyl]ethanoate

Systemtic Name: ethyl 2-[(1S,2S)-1-cyano-2-methoxy-cyclohexyl]ethanoate Openeye Name: ethyl 2-[(1S,2S)-1-cyano-2-methoxy-cyclohexyl]acetate CAS Name: 2-[(1S,2S)-1-cyano-2-methoxycyclohexyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1S,2S)-1-cyano-2-methoxycyclohexyl]acetate Traditional Name: 2-[(1S,2S)-1-cyano-2-methoxy-cyclohexyl]acetic acid ethyl ester Formula: C12H19NO3 MolecularWeight: 225.28416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCCCC1OC)C#N

Isomeric SMILES

CCOC(=O)C[C@@]1(CCCC[C@@H]1OC)C#N

InChI

InChI=1S/C12H19NO3/c1-3-16-11(14)8-12(9-13)7-5-4-6-10(12)15-2/h10H,3-8H2,1-2H3/t10-,12-/m0/s1