2-[4-(phenylmethyl)piperidin-1-yl]-5-(trifluoromethyl)pyridin-1-ium

Systemtic Name: 2-[4-(phenylmethyl)piperidin-1-yl]-5-(trifluoromethyl)pyridin-1-ium Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(trifluoromethyl)pyridin-1-ium CAS Name: 2-[4-(phenylmethyl)-1-piperidinyl]-5-(trifluoromethyl)pyridin-1-ium IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(trifluoromethyl)pyridin-1-ium Traditional Name: 2-(4-benzylpiperidino)-5-(trifluoromethyl)pyridin-1-ium Formula: C18H20F3N2+ MolecularWeight: 321.36001

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H19F3N2/c19-18(20,21)16-6-7-17(22-13-16)23-10-8-15(9-11-23)12-14-4-2-1-3-5-14/h1-7,13,15H,8-12H2/p+1