ethyl (2R)-2-cyano-3-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]imino-propanoate

Systemtic Name: ethyl (2R)-2-cyano-3-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]imino-propanoate Openeye Name: ethyl (2R)-2-cyano-3-[2-(2,6-dimethylanilino)-2-oxo-ethyl]imino-propanoate CAS Name: (2R)-2-cyano-3-[2-(2,6-dimethylanilino)-2-oxoethyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-cyano-3-[2-(2,6-dimethylanilino)-2-oxoethyl]iminopropanoate Traditional Name: (2R)-2-cyano-3-[2-(2,6-dimethylanilino)-2-keto-ethyl]imino-propionic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCC(=O)NC1=C(C=CC=C1C)C)C#N

Isomeric SMILES

CCOC(=O)[C@H](C=NCC(=O)NC1=C(C=CC=C1C)C)C#N

InChI

InChI=1S/C16H19N3O3/c1-4-22-16(21)13(8-17)9-18-10-14(20)19-15-11(2)6-5-7-12(15)3/h5-7,9,13H,4,10H2,1-3H3,(H,19,20)/t13-/m0/s1