ethyl (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyano-propanoate

Systemtic Name: ethyl (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyano-propanoate Openeye Name: ethyl (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyano-propanoate CAS Name: (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyanopropanoate Traditional Name: (2S)-3-[(1R)-1-(4-bromophenyl)ethyl]imino-2-cyano-propionic acid ethyl ester Formula: C14H15BrN2O2 MolecularWeight: 323.1851

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15BrN2O2/c1-3-19-14(18)12(8-16)9-17-10(2)11-4-6-13(15)7-5-11/h4-7,9-10,12H,3H2,1-2H3/t10-,12-/m1/s1