2,6-dimethyl-1-phenethyl-4-phenyl-pyridin-1-ium perchlorate

Systemtic Name: 2,6-dimethyl-1-phenethyl-4-phenyl-pyridin-1-ium perchlorate Openeye Name: 2,6-dimethyl-1-phenethyl-4-phenyl-pyridin-1-ium perchlorate CAS Name: 2,6-dimethyl-1-phenethyl-4-phenylpyridin-1-ium perchlorate IUPAC Name: 2,6-dimethyl-1-phenethyl-4-phenylpyridin-1-ium perchlorate Traditional Name: 2,6-dimethyl-1-phenethyl-4-phenyl-pyridin-1-ium perchlorate Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CCC2=CC=CC=C2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=CC(=[N+]1CCC2=CC=CC=C2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H22N.ClHO4/c1-17-15-21(20-11-7-4-8-12-20)16-18(2)22(17)14-13-19-9-5-3-6-10-19;2-1(3,4)5/h3-12,15-16H,13-14H2,1-2H3;(H,2,3,4,5)/q+1;/p-1