benzotriazol-1-yl-[1-(phenylmethyl)pyridin-1-ium-3-yl]methanone

Systemtic Name: benzotriazol-1-yl-[1-(phenylmethyl)pyridin-1-ium-3-yl]methanone Openeye Name: benzotriazol-1-yl-(1-benzylpyridin-1-ium-3-yl)methanone CAS Name: 1-benzotriazolyl-[1-(phenylmethyl)-3-pyridin-1-iumyl]methanone IUPAC Name: benzotriazol-1-yl-(1-benzylpyridin-1-ium-3-yl)methanone Traditional Name: benzotriazol-1-yl-(1-benzylpyridin-1-ium-3-yl)methanone Formula: C19H15N4O+ MolecularWeight: 315.3486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H15N4O/c24-19(23-18-11-5-4-10-17(18)20-21-23)16-9-6-12-22(14-16)13-15-7-2-1-3-8-15/h1-12,14H,13H2/q+1