ethyl 4-morpholin-4-yl-3-[2-(4-nitrophenyl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-morpholin-4-yl-3-[2-(4-nitrophenyl)ethanoylamino]benzoate Openeye Name: ethyl 4-morpholino-3-[[2-(4-nitrophenyl)acetyl]amino]benzoate CAS Name: 4-(4-morpholinyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-morpholin-4-yl-3-[[2-(4-nitrophenyl)acetyl]amino]benzoate Traditional Name: 4-morpholino-3-[[2-(4-nitrophenyl)acetyl]amino]benzoic acid ethyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

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