1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(1-ethylpiperidin-1-ium-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(1-ethylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-ethylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(1-ethyl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(1-ethylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-ethylpiperidin-1-ium-4-yl)isonipecotamide Formula: C19H27ClF3N4O+ MolecularWeight: 419.89209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H26ClF3N4O/c1-2-26-7-5-15(6-8-26)25-18(28)13-3-9-27(10-4-13)17-16(20)11-14(12-24-17)19(21,22)23/h11-13,15H,2-10H2,1H3,(H,25,28)/p+1