[(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [(2R)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-ethoxypyridine-3-carboxylate Openeye Name: [(1R)-1-methyl-2-(4-nitroanilino)-2-oxo-ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-nitroanilino)-1-oxopropan-2-yl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [(1R)-2-keto-1-methyl-2-(4-nitroanilino)ethyl] ester Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-3-25-16-14(5-4-10-18-16)17(22)26-11(2)15(21)19-12-6-8-13(9-7-12)20(23)24/h4-11H,3H2,1-2H3,(H,19,21)/t11-/m1/s1