methyl 4-(methoxyamino)-2-(2-nitro-3-phenylmethoxy-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(methoxyamino)-2-(2-nitro-3-phenylmethoxy-phenyl)-4-oxidanylidene-butanoate Openeye Name: methyl 2-(3-benzyloxy-2-nitro-phenyl)-4-(methoxyamino)-4-oxo-butanoate CAS Name: 4-(methoxyamino)-2-(2-nitro-3-phenylmethoxyphenyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(methoxyamino)-2-(2-nitro-3-phenylmethoxyphenyl)-4-oxobutanoate Traditional Name: 2-(3-benzoxy-2-nitro-phenyl)-4-keto-4-(methoxyamino)butyric acid methyl ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)NOC)C1=C(C(=CC=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC(=O)NOC)C1=C(C(=CC=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O7/c1-26-19(23)15(11-17(22)20-27-2)14-9-6-10-16(18(14)21(24)25)28-12-13-7-4-3-5-8-13/h3-10,15H,11-12H2,1-2H3,(H,20,22)