2,6-ditert-butyl-4-methyl-1-phenyl-pyridin-1-ium perchlorate

Systemtic Name: 2,6-ditert-butyl-4-methyl-1-phenyl-pyridin-1-ium perchlorate Openeye Name: 2,6-ditert-butyl-4-methyl-1-phenyl-pyridin-1-ium perchlorate CAS Name: 2,6-ditert-butyl-4-methyl-1-phenylpyridin-1-ium perchlorate IUPAC Name: 2,6-ditert-butyl-4-methyl-1-phenylpyridin-1-ium perchlorate Traditional Name: 2,6-ditert-butyl-4-methyl-1-phenyl-pyridin-1-ium perchlorate Formula: C20H28ClNO4 MolecularWeight: 381.89362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C(C)(C)C)C2=CC=CC=C2)C(C)(C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C(C)(C)C)C2=CC=CC=C2)C(C)(C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H28N.ClHO4/c1-15-13-17(19(2,3)4)21(16-11-9-8-10-12-16)18(14-15)20(5,6)7;2-1(3,4)5/h8-14H,1-7H3;(H,2,3,4,5)/q+1;/p-1