ethyl 4-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-[(4-morpholino-3-nitro-benzoyl)amino]benzoate CAS Name: 4-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(4-morpholino-3-nitro-benzoyl)amino]benzoic acid ethyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-2-29-20(25)14-3-6-16(7-4-14)21-19(24)15-5-8-17(18(13-15)23(26)27)22-9-11-28-12-10-22/h3-8,13H,2,9-12H2,1H3,(H,21,24)