[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C18H15N3O6 MolecularWeight: 369.3282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H15N3O6/c1-12(27-14-8-6-13(10-19)7-9-14)18(23)26-11-17(22)20-15-4-2-3-5-16(15)21(24)25/h2-9,12H,11H2,1H3,(H,20,22)/t12-/m0/s1