[(2S,3R)-2-cyanopentan-3-yl] ethanoate

Systemtic Name: [(2S,3R)-2-cyanopentan-3-yl] ethanoate Openeye Name: [(1R,2S)-2-cyano-1-ethyl-propyl] acetate CAS Name: acetic acid [(2S,3R)-2-cyanopentan-3-yl] ester IUPAC Name: [(2S,3R)-2-cyanopentan-3-yl] acetate Traditional Name: acetic acid [(1R,2S)-2-cyano-1-ethyl-propyl] ester Formula: C8H13NO2 MolecularWeight: 155.19432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C#N)OC(=O)C

Isomeric SMILES

CC[C@H]([C@@H](C)C#N)OC(=O)C

InChI

InChI=1S/C8H13NO2/c1-4-8(6(2)5-9)11-7(3)10/h6,8H,4H2,1-3H3/t6-,8+/m0/s1