ethyl 3-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]benzoate Openeye Name: ethyl 3-[(2-morpholino-5-nitro-benzoyl)amino]benzoate CAS Name: 3-[[[2-(4-morpholinyl)-5-nitrophenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-morpholin-4-yl-5-nitrobenzoyl)amino]benzoate Traditional Name: 3-[(2-morpholino-5-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(=CC=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

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

InChI

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