O3-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(3,5-dimethylanilino)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3,5-dimethylanilino)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(3,5-dimethylanilino)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3,5-dimethylanilino)-2-keto-ethyl] ester O1-ethyl ester Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O7/c1-4-28-19(24)14-8-15(10-17(9-14)22(26)27)20(25)29-11-18(23)21-16-6-12(2)5-13(3)7-16/h5-10H,4,11H2,1-3H3,(H,21,23)