2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)pyrrolidin-1-ium-1-yl]ethanenitrile

Systemtic Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)pyrrolidin-1-ium-1-yl]ethanenitrile Openeye Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridylmethyl)pyrrolidin-1-ium-1-yl]acetonitrile CAS Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridinylmethyl)-1-pyrrolidin-1-iumyl]acetonitrile IUPAC Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)pyrrolidin-1-ium-1-yl]acetonitrile Traditional Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridylmethyl)pyrrolidin-1-ium-1-yl]acetonitrile Formula: C19H21N6+ MolecularWeight: 333.41024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(CC#N)CC2=CC=CC=N2)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC([N+](C1)(CC#N)CC2=CC=CC=N2)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H21N6/c20-10-13-25(14-15-6-3-4-11-21-15)12-5-9-18(25)24-19-22-16-7-1-2-8-17(16)23-19/h1-4,6-8,11,18H,5,9,12-14H2,(H2,22,23,24)/q+1