ethyl 3-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate

Systemtic Name: ethyl 3-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate Openeye Name: ethyl 3-[(1R)-2-(2-methoxy-5-nitro-anilino)-1-methyl-2-oxo-ethoxy]benzoate CAS Name: 3-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]oxybenzoic acid ethyl ester IUPAC Name: ethyl 3-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 3-[(1R)-2-keto-2-(2-methoxy-5-nitro-anilino)-1-methyl-ethoxy]benzoic acid ethyl ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)OC(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)O[C@H](C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N2O7/c1-4-27-19(23)13-6-5-7-15(10-13)28-12(2)18(22)20-16-11-14(21(24)25)8-9-17(16)26-3/h5-12H,4H2,1-3H3,(H,20,22)/t12-/m1/s1