2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanoic acid

Systemtic Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanoic acid Openeye Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetic acid CAS Name: 2-(2-butyl-4,6-diphenyl-1-pyridin-1-iumyl)acetic acid IUPAC Name: 2-(2-butyl-4,6-diphenylpyridin-1-ium-1-yl)acetic acid Traditional Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetic acid Formula: C23H24NO2+ MolecularWeight: 346.44216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=[N+]1CC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=CC(=[N+]1CC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO2/c1-2-3-14-21-15-20(18-10-6-4-7-11-18)16-22(24(21)17-23(25)26)19-12-8-5-9-13-19/h4-13,15-16H,2-3,14,17H2,1H3/p+1