ethyl (2S)-2-cyano-3-[2-(3,4-dimethoxyphenyl)ethylimino]propanoate

Systemtic Name: ethyl (2S)-2-cyano-3-[2-(3,4-dimethoxyphenyl)ethylimino]propanoate Openeye Name: ethyl (2S)-2-cyano-3-[2-(3,4-dimethoxyphenyl)ethylimino]propanoate CAS Name: (2S)-2-cyano-3-[2-(3,4-dimethoxyphenyl)ethylimino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-3-[2-(3,4-dimethoxyphenyl)ethylimino]propanoate Traditional Name: (2S)-2-cyano-3-homoveratrylimino-propionic acid ethyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCCC1=CC(=C(C=C1)OC)OC)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=NCCC1=CC(=C(C=C1)OC)OC)C#N

InChI

InChI=1S/C16H20N2O4/c1-4-22-16(19)13(10-17)11-18-8-7-12-5-6-14(20-2)15(9-12)21-3/h5-6,9,11,13H,4,7-8H2,1-3H3/t13-/m1/s1