1-[1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-4-yl]carbonylpiperidine-3-carboxamide

Systemtic Name: 1-[1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-4-yl]carbonylpiperidine-3-carboxamide Openeye Name: 1-[1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carbonyl]piperidine-3-carboxamide CAS Name: 1-[[1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: 1-[1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carbonyl]piperidine-3-carboxamide Traditional Name: 1-[1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotoyl]nipecotamide Formula: C19H23F3N4O4 MolecularWeight: 428.40553

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C19H23F3N4O4/c20-19(21,22)14-3-4-15(16(10-14)26(29)30)24-8-5-12(6-9-24)18(28)25-7-1-2-13(11-25)17(23)27/h3-4,10,12-13H,1-2,5-9,11H2,(H2,23,27)