3,3-dimethyl-6-[2-(4-methylphenyl)ethyl]-2-pyridin-2-yl-4H-pyrimidin-3-ium

Systemtic Name: 3,3-dimethyl-6-[2-(4-methylphenyl)ethyl]-2-pyridin-2-yl-4H-pyrimidin-3-ium Openeye Name: 3,3-dimethyl-6-[2-(p-tolyl)ethyl]-2-(2-pyridyl)-4H-pyrimidin-3-ium CAS Name: 3,3-dimethyl-6-[2-(4-methylphenyl)ethyl]-2-(2-pyridinyl)-4H-pyrimidin-3-ium IUPAC Name: 3,3-dimethyl-6-[2-(4-methylphenyl)ethyl]-2-pyridin-2-yl-4H-pyrimidin-3-ium Traditional Name: 3,3-dimethyl-6-[2-(p-tolyl)ethyl]-2-(2-pyridyl)-4H-pyrimidin-3-ium Formula: C20H24N3+ MolecularWeight: 306.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2=CC[N+](C(=N2)C3=CC=CC=N3)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC2=CC[N+](C(=N2)C3=CC=CC=N3)(C)C

InChI

InChI=1S/C20H24N3/c1-16-7-9-17(10-8-16)11-12-18-13-15-23(2,3)20(22-18)19-6-4-5-14-21-19/h4-10,13-14H,11-12,15H2,1-3H3/q+1