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

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

Isomeric SMILES

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

InChI

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