2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: 2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: 2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyanopyrrolidin-1-yl)-2-oxo-ethyl]-dimethyl-ammonium CAS Name: 2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyano-1-pyrrolidinyl)-2-oxoethyl]-dimethylammonium IUPAC Name: 2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyanopyrrolidin-1-yl)-2-oxoethyl]-dimethylazanium Traditional Name: 2-[1H-benzimidazol-2-yl(methyl)amino]ethyl-[2-(2-cyanopyrrolidino)-2-keto-ethyl]-dimethyl-ammonium Formula: C19H27N6O+ MolecularWeight: 355.45728

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[N+](C)(C)CC(=O)N1CCCC1C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CN(CC[N+](C)(C)CC(=O)N1CCCC1C#N)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H27N6O/c1-23(19-21-16-8-4-5-9-17(16)22-19)11-12-25(2,3)14-18(26)24-10-6-7-15(24)13-20/h4-5,8-9,15H,6-7,10-12,14H2,1-3H3,(H,21,22)/q+1