2-[4-(2,4-dimethylphenyl)pyrimidin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[4-(2,4-dimethylphenyl)pyrimidin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[4-(2,4-dimethylphenyl)pyrimidin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone CAS Name: 2-[4-(2,4-dimethylphenyl)-1-pyrimidin-1-iumyl]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[4-(2,4-dimethylphenyl)pyrimidin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Traditional Name: 2-[4-(2,4-dimethylphenyl)pyrimidin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone Formula: C21H21N2O2+ MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H21N2O2/c1-15-4-9-19(16(2)12-15)20-10-11-23(14-22-20)13-21(24)17-5-7-18(25-3)8-6-17/h4-12,14H,13H2,1-3H3/q+1