N2-methyl-N2-(2-pyridin-4-ylethyl)pyridin-1-ium-2,3-diamine

Systemtic Name: N2-methyl-N2-(2-pyridin-4-ylethyl)pyridin-1-ium-2,3-diamine Openeye Name: N2-methyl-N2-[2-(4-pyridyl)ethyl]pyridin-1-ium-2,3-diamine CAS Name: N2-methyl-N2-(2-pyridin-4-ylethyl)pyridin-1-ium-2,3-diamine IUPAC Name: 2-N-methyl-2-N-(2-pyridin-4-ylethyl)pyridin-1-ium-2,3-diamine Traditional Name: (3-aminopyridin-1-ium-2-yl)-methyl-[2-(4-pyridyl)ethyl]amine Formula: C13H17N4+ MolecularWeight: 229.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C2=C(C=CC=[NH+]2)N

Isomeric SMILES

CN(CCC1=CC=NC=C1)C2=C(C=CC=[NH+]2)N

InChI

InChI=1S/C13H16N4/c1-17(13-12(14)3-2-7-16-13)10-6-11-4-8-15-9-5-11/h2-5,7-9H,6,10,14H2,1H3/p+1