ethyl (2S)-2-cyano-3-(2-nitrophenyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-cyano-3-(2-nitrophenyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: ethyl (2S)-2-cyano-3-(2-nitrophenyl)-3-oxo-2-phenyl-propanoate CAS Name: (2S)-2-cyano-3-(2-nitrophenyl)-3-oxo-2-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-3-(2-nitrophenyl)-3-oxo-2-phenylpropanoate Traditional Name: (2S)-2-cyano-3-keto-3-(2-nitrophenyl)-2-phenyl-propionic acid ethyl ester Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)(C1=CC=CC=C1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@](C#N)(C1=CC=CC=C1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5/c1-2-25-17(22)18(12-19,13-8-4-3-5-9-13)16(21)14-10-6-7-11-15(14)20(23)24/h3-11H,2H2,1H3/t18-/m1/s1