ethyl 2-morpholin-4-yl-5-[(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 2-morpholin-4-yl-5-[(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 2-morpholino-5-[(5-nitro-2-pyrrolidin-1-yl-benzoyl)amino]benzoate CAS Name: 2-(4-morpholinyl)-5-[[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-morpholin-4-yl-5-[(5-nitro-2-pyrrolidin-1-ylbenzoyl)amino]benzoate Traditional Name: 2-morpholino-5-[(5-nitro-2-pyrrolidino-benzoyl)amino]benzoic acid ethyl ester Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)N4CCOCC4

InChI

InChI=1S/C24H28N4O6/c1-2-34-24(30)20-15-17(5-7-22(20)27-11-13-33-14-12-27)25-23(29)19-16-18(28(31)32)6-8-21(19)26-9-3-4-10-26/h5-8,15-16H,2-4,9-14H2,1H3,(H,25,29)