diethyl 5-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(4-ethoxy-5-methoxy-2-nitrophenyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(4-ethoxy-5-methoxy-2-nitrobenzoyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H24N2O9 MolecularWeight: 460.43396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)OCC)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)OCC)C(=O)OCC)OC

InChI

InChI=1S/C22H24N2O9/c1-5-31-19-12-17(24(28)29)16(11-18(19)30-4)20(25)23-15-9-13(21(26)32-6-2)8-14(10-15)22(27)33-7-3/h8-12H,5-7H2,1-4H3,(H,23,25)