methyl (2S)-2-cyano-2-(2-nitrophenyl)ethanoate

Systemtic Name: methyl (2S)-2-cyano-2-(2-nitrophenyl)ethanoate Openeye Name: methyl (2S)-2-cyano-2-(2-nitrophenyl)acetate CAS Name: (2S)-2-cyano-2-(2-nitrophenyl)acetic acid methyl ester IUPAC Name: methyl (2S)-2-cyano-2-(2-nitrophenyl)acetate Traditional Name: (2S)-2-cyano-2-(2-nitrophenyl)acetic acid methyl ester Formula: C10H8N2O4 MolecularWeight: 220.18152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8N2O4/c1-16-10(13)8(6-11)7-4-2-3-5-9(7)12(14)15/h2-5,8H,1H3/t8-/m1/s1