2-butyl-4,6-diphenyl-1-(2H-1,2,3-triazol-4-yl)pyridin-1-ium perchlorate

Systemtic Name: 2-butyl-4,6-diphenyl-1-(2H-1,2,3-triazol-4-yl)pyridin-1-ium perchlorate Openeye Name: 2-butyl-4,6-diphenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate CAS Name: 2-butyl-4,6-diphenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate IUPAC Name: 2-butyl-4,6-diphenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Traditional Name: 2-butyl-4,6-diphenyl-1-(2H-triazol-4-yl)pyridin-1-ium perchlorate Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=[N+]1C2=NNN=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCC1=CC(=CC(=[N+]1C2=NNN=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H23N4.ClHO4/c1-2-3-14-21-15-20(18-10-6-4-7-11-18)16-22(19-12-8-5-9-13-19)27(21)23-17-24-26-25-23;2-1(3,4)5/h4-13,15-17H,2-3,14H2,1H3,(H,24,25,26);(H,2,3,4,5)/q+1;/p-1