methyl 4-morpholin-4-yl-3-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-morpholin-4-yl-3-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: methyl 4-morpholino-3-[[5-nitro-2-(1-piperidyl)benzoyl]amino]benzoate CAS Name: 4-(4-morpholinyl)-3-[[[5-nitro-2-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-morpholin-4-yl-3-[(5-nitro-2-piperidin-1-ylbenzoyl)amino]benzoate Traditional Name: 4-morpholino-3-[(5-nitro-2-piperidino-benzoyl)amino]benzoic acid methyl ester Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4

InChI

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