(2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butanoate

Systemtic Name: (2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butanoate Openeye Name: (2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butanoate CAS Name: (2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butanoate IUPAC Name: (2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butanoate Traditional Name: (2R,3R)-2-cyano-3-(3,4-dimethoxyphenyl)butyrate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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