ethyl 1-(5-bromanylpyridin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate

Systemtic Name: ethyl 1-(5-bromanylpyridin-2-yl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate Openeye Name: ethyl 1-(5-bromo-2-pyridyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate CAS Name: 1-(5-bromo-2-pyridinyl)-4,6-diphenyl-2-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-bromopyridin-2-yl)-4,6-diphenylpyridin-1-ium-2-carboxylate Traditional Name: 1-(5-bromo-2-pyridyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylic acid ethyl ester Formula: C25H20BrN2O2+ MolecularWeight: 460.3425

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20BrN2O2/c1-2-30-25(29)23-16-20(18-9-5-3-6-10-18)15-22(19-11-7-4-8-12-19)28(23)24-14-13-21(26)17-27-24/h3-17H,2H2,1H3/q+1