ethyl (2S)-3-(4-aminophenyl)-2-cyano-3-oxidanylidene-propanoate

Systemtic Name: ethyl (2S)-3-(4-aminophenyl)-2-cyano-3-oxidanylidene-propanoate Openeye Name: ethyl (2S)-3-(4-aminophenyl)-2-cyano-3-oxo-propanoate CAS Name: (2S)-3-(4-aminophenyl)-2-cyano-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-(4-aminophenyl)-2-cyano-3-oxopropanoate Traditional Name: (2S)-3-(4-aminophenyl)-2-cyano-3-keto-propionic acid ethyl ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O3/c1-2-17-12(16)10(7-13)11(15)8-3-5-9(14)6-4-8/h3-6,10H,2,14H2,1H3/t10-/m0/s1