ethyl (2S)-2-cyano-2-(2-nitrophenyl)propanoate

Systemtic Name: ethyl (2S)-2-cyano-2-(2-nitrophenyl)propanoate Openeye Name: ethyl (2S)-2-cyano-2-(2-nitrophenyl)propanoate CAS Name: (2S)-2-cyano-2-(2-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-2-(2-nitrophenyl)propanoate Traditional Name: (2S)-2-cyano-2-(2-nitrophenyl)propionic acid ethyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O4/c1-3-18-11(15)12(2,8-13)9-6-4-5-7-10(9)14(16)17/h4-7H,3H2,1-2H3/t12-/m1/s1