3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)propanoic acid perchlorate

Systemtic Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)propanoic acid perchlorate Openeye Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)propanoic acid perchlorate CAS Name: 3-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)propanoic acid perchlorate IUPAC Name: 3-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)propanoic acid perchlorate Traditional Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)propionic acid perchlorate Formula: C16H18ClNO6 MolecularWeight: 355.77022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO2.ClHO4/c1-12-10-15(14-6-4-3-5-7-14)11-13(2)17(12)9-8-16(18)19;2-1(3,4)5/h3-7,10-11H,8-9H2,1-2H3;(H,2,3,4,5)