N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[4-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C17H20F3N4+ MolecularWeight: 337.36271

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=NC=CC(=N2)C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC2=NC=CC(=N2)C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C17H19F3N4/c18-17(19,20)15-6-9-21-16(23-15)22-14-7-10-24(11-8-14)12-13-4-2-1-3-5-13/h1-6,9,14H,7-8,10-12H2,(H,21,22,23)/p+1