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

Systemtic Name: diethyl 5-[[2-(2-methoxyethylamino)-5-nitro-phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(2-methoxyethylamino)-5-nitro-benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[2-(2-methoxyethylamino)-5-nitrophenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(2-methoxyethylamino)-5-nitrobenzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(2-methoxyethylamino)-5-nitro-benzoyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H25N3O8 MolecularWeight: 459.4492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O8/c1-4-32-21(27)14-10-15(22(28)33-5-2)12-16(11-14)24-20(26)18-13-17(25(29)30)6-7-19(18)23-8-9-31-3/h6-7,10-13,23H,4-5,8-9H2,1-3H3,(H,24,26)