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

Systemtic Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanoic acid perchlorate Openeye Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetic acid perchlorate CAS Name: 2-(2-butyl-4,6-diphenyl-1-pyridin-1-iumyl)acetic acid perchlorate IUPAC Name: 2-(2-butyl-4,6-diphenylpyridin-1-ium-1-yl)acetic acid perchlorate Traditional Name: 2-(2-butyl-4,6-diphenyl-pyridin-1-ium-1-yl)acetic acid perchlorate Formula: C23H24ClNO6 MolecularWeight: 445.89276

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.[O-]Cl(=O)(=O)=O

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO2.ClHO4/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;2-1(3,4)5/h4-13,15-16H,2-3,14,17H2,1H3;(H,2,3,4,5)