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

Systemtic Name: 1-(pyridin-1-ium-1-ylmethyl)benzotriazole perchlorate Openeye Name: 1-(pyridin-1-ium-1-ylmethyl)benzotriazole perchlorate CAS Name: 1-(1-pyridin-1-iumylmethyl)benzotriazole perchlorate IUPAC Name: 1-(pyridin-1-ium-1-ylmethyl)benzotriazole perchlorate Traditional Name: 1-(pyridin-1-ium-1-ylmethyl)benzotriazole perchlorate Formula: C12H11ClN4O4 MolecularWeight: 310.69314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CN2C3=CC=CC=C3N=N2.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=[N+](C=C1)CN2C3=CC=CC=C3N=N2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H11N4.ClHO4/c1-4-8-15(9-5-1)10-16-12-7-3-2-6-11(12)13-14-16;2-1(3,4)5/h1-9H,10H2;(H,2,3,4,5)/q+1;/p-1