(2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butanoate

Systemtic Name: (2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butanoate Openeye Name: (2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butanoate CAS Name: (2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butanoate IUPAC Name: (2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butanoate Traditional Name: (2R,3R)-2-cyano-3-(2,5-dimethoxyphenyl)butyrate Formula: C13H14NO4- MolecularWeight: 248.25456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)C(C#N)C(=O)[O-]

Isomeric SMILES

C[C@@H](C1=C(C=CC(=C1)OC)OC)[C@H](C#N)C(=O)[O-]

InChI

InChI=1S/C13H15NO4/c1-8(11(7-14)13(15)16)10-6-9(17-2)4-5-12(10)18-3/h4-6,8,11H,1-3H3,(H,15,16)/p-1/t8-,11-/m0/s1