2,3,6-trimethyl-4-phenyl-1-(2H-1,2,3-triazol-4-yl)pyridin-1-ium perchlorate

Systemtic Name: 2,3,6-trimethyl-4-phenyl-1-(2H-1,2,3-triazol-4-yl)pyridin-1-ium perchlorate Openeye Name: 2,3,6-trimethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate CAS Name: 2,3,6-trimethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate IUPAC Name: 2,3,6-trimethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Traditional Name: 2,3,6-trimethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Formula: C16H17ClN4O4 MolecularWeight: 364.78358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=C(C(=C1)C2=CC=CC=C2)C)C)C3=NNN=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C(=C(C(=C1)C2=CC=CC=C2)C)C)C3=NNN=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H17N4.ClHO4/c1-11-9-15(14-7-5-4-6-8-14)12(2)13(3)20(11)16-10-17-19-18-16;2-1(3,4)5/h4-10H,1-3H3,(H,17,18,19);(H,2,3,4,5)/q+1;/p-1