2-tert-butyl-4,6-diphenyl-1-(phenylmethyl)pyridin-1-ium perchlorate

Systemtic Name: 2-tert-butyl-4,6-diphenyl-1-(phenylmethyl)pyridin-1-ium perchlorate Openeye Name: 1-benzyl-2-tert-butyl-4,6-diphenyl-pyridin-1-ium perchlorate CAS Name: 2-tert-butyl-4,6-diphenyl-1-(phenylmethyl)pyridin-1-ium perchlorate IUPAC Name: 1-benzyl-2-tert-butyl-4,6-diphenylpyridin-1-ium perchlorate Traditional Name: 1-benzyl-2-tert-butyl-4,6-diphenyl-pyridin-1-ium perchlorate Formula: C28H28ClNO4 MolecularWeight: 477.97922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=[N+]1CC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=[N+]1CC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H28N.ClHO4/c1-28(2,3)27-20-25(23-15-9-5-10-16-23)19-26(24-17-11-6-12-18-24)29(27)21-22-13-7-4-8-14-22;2-1(3,4)5/h4-20H,21H2,1-3H3;(H,2,3,4,5)/q+1;/p-1