[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] (2R)-2-phenoxybutanoate

Systemtic Name: [(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] (2R)-2-phenoxybutanoate Openeye Name: [(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O6/c1-3-17(27-14-9-5-4-6-10-14)19(23)26-13(2)18(22)20-15-11-7-8-12-16(15)21(24)25/h4-13,17H,3H2,1-2H3,(H,20,22)/t13-,17-/m1/s1