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

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-1-yl]pyrimidin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-1-yl)pyrimidin-4-amine CAS Name: N-[1-(phenylmethyl)-1-piperidin-1-iumyl]-4-pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-1-yl)pyrimidin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-1-yl)-(4-pyrimidyl)amine Formula: C16H21N4+ MolecularWeight: 269.36474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC2=CC=CC=C2)NC3=NC=NC=C3

Isomeric SMILES

C1CC[N+](CC1)(CC2=CC=CC=C2)NC3=NC=NC=C3

InChI

InChI=1S/C16H21N4/c1-3-7-15(8-4-1)13-20(11-5-2-6-12-20)19-16-9-10-17-14-18-16/h1,3-4,7-10,14H,2,5-6,11-13H2,(H,17,18,19)/q+1