ethyl 4-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22N4O5 MolecularWeight: 350.36968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H](C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O5/c1-3-25-16(22)19-10-8-18(9-11-19)12(2)15(21)17-13-6-4-5-7-14(13)20(23)24/h4-7,12H,3,8-11H2,1-2H3,(H,17,21)/t12-/m1/s1