1-[2-[(4-methoxy-3-nitro-phenyl)carbonylamino]-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-methoxy-3-nitro-phenyl)carbonylamino]-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(4-methoxy-3-nitro-benzoyl)amino]-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-methoxy-3-nitrobenzoyl)amino]-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-methoxy-3-nitro-benzoyl)amino]-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C21H21F3N4O5 MolecularWeight: 466.41045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCC(CC3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCC(CC3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H21F3N4O5/c1-33-18-5-2-13(10-17(18)28(31)32)20(30)26-15-11-14(21(22,23)24)3-4-16(15)27-8-6-12(7-9-27)19(25)29/h2-5,10-12H,6-9H2,1H3,(H2,25,29)(H,26,30)