N-(benzotriazol-1-ylmethyl)-1-(nonoxymethyl)pyridin-1-ium-3-amine

Systemtic Name: N-(benzotriazol-1-ylmethyl)-1-(nonoxymethyl)pyridin-1-ium-3-amine Openeye Name: N-(benzotriazol-1-ylmethyl)-1-(nonoxymethyl)pyridin-1-ium-3-amine CAS Name: N-(1-benzotriazolylmethyl)-1-(nonoxymethyl)-3-pyridin-1-iumamine IUPAC Name: N-(benzotriazol-1-ylmethyl)-1-(nonoxymethyl)pyridin-1-ium-3-amine Traditional Name: benzotriazol-1-ylmethyl-[1-(nonoxymethyl)pyridin-1-ium-3-yl]amine Formula: C22H32N5O+ MolecularWeight: 382.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC[N+]1=CC=CC(=C1)NCN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCCCCCOC[N+]1=CC=CC(=C1)NCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C22H32N5O/c1-2-3-4-5-6-7-10-16-28-19-26-15-11-12-20(17-26)23-18-27-22-14-9-8-13-21(22)24-25-27/h8-9,11-15,17,23H,2-7,10,16,18-19H2,1H3/q+1