ethyl (2S)-3-[(1R)-1-(1-benzofuran-2-yl)ethyl]imino-2-cyano-propanoate

Systemtic Name: ethyl (2S)-3-[(1R)-1-(1-benzofuran-2-yl)ethyl]imino-2-cyano-propanoate Openeye Name: ethyl (2S)-3-[(1R)-1-(benzofuran-2-yl)ethyl]imino-2-cyano-propanoate CAS Name: (2S)-3-[(1R)-1-(2-benzofuranyl)ethyl]imino-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-[(1R)-1-(1-benzofuran-2-yl)ethyl]imino-2-cyanopropanoate Traditional Name: (2S)-3-[(1R)-1-(benzofuran-2-yl)ethyl]imino-2-cyano-propionic acid ethyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NC(C)C1=CC2=CC=CC=C2O1)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=N[C@H](C)C1=CC2=CC=CC=C2O1)C#N

InChI

InChI=1S/C16H16N2O3/c1-3-20-16(19)13(9-17)10-18-11(2)15-8-12-6-4-5-7-14(12)21-15/h4-8,10-11,13H,3H2,1-2H3/t11-,13-/m1/s1