N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C24H36F3N4O+ MolecularWeight: 453.56405

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)[NH+]4CCCCC4

InChI

InChI=1S/C24H35F3N4O/c25-24(26,27)20-7-8-21(28-17-20)30-15-9-19(10-16-30)22(32)29-18-23(11-3-1-4-12-23)31-13-5-2-6-14-31/h7-8,17,19H,1-6,9-16,18H2,(H,29,32)/p+1