N-[(2-phenylpyrimidin-5-yl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-[(2-phenylpyrimidin-5-yl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(2-phenylpyrimidin-5-yl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(2-phenyl-5-pyrimidinyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(2-phenylpyrimidin-5-yl)methyl]pyridin-1-ium-2-amine Traditional Name: (2-phenylpyrimidin-5-yl)methyl-pyridin-1-ium-2-yl-amine Formula: C16H15N4+ MolecularWeight: 263.3171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C(C=N2)CNC3=CC=CC=[NH+]3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C(C=N2)CNC3=CC=CC=[NH+]3

InChI

InChI=1S/C16H14N4/c1-2-6-14(7-3-1)16-19-11-13(12-20-16)10-18-15-8-4-5-9-17-15/h1-9,11-12H,10H2,(H,17,18)/p+1