2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate

Systemtic Name: 2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate Openeye Name: 2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate CAS Name: 2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate IUPAC Name: 2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate Traditional Name: 2,6-dimethyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium perchlorate Formula: C16H16ClN3O4 MolecularWeight: 349.76894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1C2=CC=NN2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=CC(=[N+]1C2=CC=NN2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H16N3.ClHO4/c1-12-10-15(14-6-4-3-5-7-14)11-13(2)19(12)16-8-9-17-18-16;2-1(3,4)5/h3-11H,1-2H3,(H,17,18);(H,2,3,4,5)/q+1;/p-1