ethyl 1-(4,6-dimethylpyrimidin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate

Systemtic Name: ethyl 1-(4,6-dimethylpyrimidin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate Openeye Name: ethyl 1-(4,6-dimethylpyrimidin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-4,6-diphenyl-2-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4,6-dimethylpyrimidin-2-yl)-4,6-diphenylpyridin-1-ium-2-carboxylate Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylic acid ethyl ester Formula: C26H24N3O2+ MolecularWeight: 410.48766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=[N+]1C2=NC(=CC(=N2)C)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=[N+]1C2=NC(=CC(=N2)C)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N3O2/c1-4-31-25(30)24-17-22(20-11-7-5-8-12-20)16-23(21-13-9-6-10-14-21)29(24)26-27-18(2)15-19(3)28-26/h5-17H,4H2,1-3H3/q+1