1-[4-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)phenyl]ethanone perchlorate

Systemtic Name: 1-[4-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)phenyl]ethanone perchlorate Openeye Name: 1-[4-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)phenyl]ethanone perchlorate CAS Name: 1-[4-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)phenyl]ethanone perchlorate IUPAC Name: 1-[4-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)phenyl]ethanone perchlorate Traditional Name: 1-[4-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)phenyl]ethanone perchlorate Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20NO.ClHO4/c1-15-13-20(19-7-5-4-6-8-19)14-16(2)22(15)21-11-9-18(10-12-21)17(3)23;2-1(3,4)5/h4-14H,1-3H3;(H,2,3,4,5)/q+1;/p-1