1-(1-pyridin-1-ium-1-ylpropyl)benzotriazole perchlorate

Systemtic Name: 1-(1-pyridin-1-ium-1-ylpropyl)benzotriazole perchlorate Openeye Name: 1-(1-pyridin-1-ium-1-ylpropyl)benzotriazole perchlorate CAS Name: 1-[1-(1-pyridin-1-iumyl)propyl]benzotriazole perchlorate IUPAC Name: 1-(1-pyridin-1-ium-1-ylpropyl)benzotriazole perchlorate Traditional Name: 1-(1-pyridin-1-ium-1-ylpropyl)benzotriazole perchlorate Formula: C14H15ClN4O4 MolecularWeight: 338.7463

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C2=CC=CC=C2N=N1)[N+]3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC(N1C2=CC=CC=C2N=N1)[N+]3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H15N4.ClHO4/c1-2-14(17-10-6-3-7-11-17)18-13-9-5-4-8-12(13)15-16-18;2-1(3,4)5/h3-11,14H,2H2,1H3;(H,2,3,4,5)/q+1;/p-1