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

Systemtic Name: ethyl 4-morpholin-4-yl-3-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 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=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

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

InChI

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