ethyl 4-morpholin-4-yl-3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-morpholin-4-yl-3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-morpholino-3-[[3-nitro-4-(1-piperidyl)benzoyl]amino]benzoate CAS Name: 4-(4-morpholinyl)-3-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-morpholin-4-yl-3-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]benzoate Traditional Name: 4-morpholino-3-[(3-nitro-4-piperidino-benzoyl)amino]benzoic acid ethyl ester Formula: C25H30N4O6 MolecularWeight: 482.5289

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O6/c1-2-35-25(31)19-7-8-21(28-12-14-34-15-13-28)20(16-19)26-24(30)18-6-9-22(23(17-18)29(32)33)27-10-4-3-5-11-27/h6-9,16-17H,2-5,10-15H2,1H3,(H,26,30)