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

Systemtic Name: 2,6-diethyl-4-phenyl-1-(2H-1,2,3-triazol-4-yl)pyridin-1-ium perchlorate Openeye Name: 2,6-diethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate CAS Name: 2,6-diethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate IUPAC Name: 2,6-diethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Traditional Name: 2,6-diethyl-4-phenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1C2=NNN=C2)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1C2=NNN=C2)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H19N4.ClHO4/c1-3-15-10-14(13-8-6-5-7-9-13)11-16(4-2)21(15)17-12-18-20-19-17;2-1(3,4)5/h5-12H,3-4H2,1-2H3,(H,18,19,20);(H,2,3,4,5)/q+1;/p-1