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

Systemtic Name: propyl 4-[(2-morpholin-4-yl-5-nitro-phenyl)carbonylamino]benzoate Openeye Name: propyl 4-[(2-morpholino-5-nitro-benzoyl)amino]benzoate CAS Name: 4-[[[2-(4-morpholinyl)-5-nitrophenyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-morpholin-4-yl-5-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(2-morpholino-5-nitro-benzoyl)amino]benzoic acid propyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O6/c1-2-11-30-21(26)15-3-5-16(6-4-15)22-20(25)18-14-17(24(27)28)7-8-19(18)23-9-12-29-13-10-23/h3-8,14H,2,9-13H2,1H3,(H,22,25)