2-tert-butyl-4-phenyl-1-(phenylmethyl)-6-pyridin-2-yl-pyridin-1-ium perchlorate

Systemtic Name: 2-tert-butyl-4-phenyl-1-(phenylmethyl)-6-pyridin-2-yl-pyridin-1-ium perchlorate Openeye Name: 1-benzyl-2-tert-butyl-4-phenyl-6-(2-pyridyl)pyridin-1-ium perchlorate CAS Name: 2-tert-butyl-4-phenyl-1-(phenylmethyl)-6-(2-pyridinyl)pyridin-1-ium perchlorate IUPAC Name: 1-benzyl-2-tert-butyl-4-phenyl-6-pyridin-2-ylpyridin-1-ium perchlorate Traditional Name: 1-benzyl-2-tert-butyl-4-phenyl-6-(2-pyridyl)pyridin-1-ium perchlorate Formula: C27H27ClN2O4 MolecularWeight: 478.96728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=[N+]1CC2=CC=CC=C2)C3=CC=CC=N3)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=N3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C27H27N2.ClHO4/c1-27(2,3)26-19-23(22-14-8-5-9-15-22)18-25(24-16-10-11-17-28-24)29(26)20-21-12-6-4-7-13-21;2-1(3,4)5/h4-19H,20H2,1-3H3;(H,2,3,4,5)/q+1;/p-1