1,4-bis(phenylmethyl)-1,2,4-triazol-4-ium

Systemtic Name: 1,4-bis(phenylmethyl)-1,2,4-triazol-4-ium Openeye Name: 1,4-dibenzyl-1,2,4-triazol-4-ium CAS Name: 1,4-bis(phenylmethyl)-1,2,4-triazol-4-ium IUPAC Name: 1,4-dibenzyl-1,2,4-triazol-4-ium Traditional Name: 1,4-dibenzyl-1,2,4-triazol-4-ium Formula: C16H16N3+ MolecularWeight: 250.31834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=[N+](C=N2)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=[N+](C=N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H16N3/c1-3-7-15(8-4-1)11-18-13-17-19(14-18)12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2/q+1