[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6/c1-2-16(26-13-8-4-3-5-9-13)18(22)25-12-17(21)19-14-10-6-7-11-15(14)20(23)24/h3-11,16H,2,12H2,1H3,(H,19,21)/t16-/m1/s1