N-(phenylmethyl)-3-(trifluoromethyl)pyridin-1-ium-2-amine

Systemtic Name: N-(phenylmethyl)-3-(trifluoromethyl)pyridin-1-ium-2-amine Openeye Name: N-benzyl-3-(trifluoromethyl)pyridin-1-ium-2-amine CAS Name: N-(phenylmethyl)-3-(trifluoromethyl)-2-pyridin-1-iumamine IUPAC Name: N-benzyl-3-(trifluoromethyl)pyridin-1-ium-2-amine Traditional Name: benzyl-[3-(trifluoromethyl)pyridin-1-ium-2-yl]amine Formula: C13H12F3N2+ MolecularWeight: 253.24299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)C(F)(F)F

InChI

InChI=1S/C13H11F3N2/c14-13(15,16)11-7-4-8-17-12(11)18-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,18)/p+1