[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-[3-(4-pyridin-3-ylimidazol-1-yl)propyl]azanium

Systemtic Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-[3-(4-pyridin-3-ylimidazol-1-yl)propyl]azanium Openeye Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxo-ethyl]-dimethyl-[3-[4-(3-pyridyl)imidazol-1-yl]propyl]ammonium CAS Name: [2-(2-cyano-1-pyrrolidinyl)-2-oxoethyl]-dimethyl-[3-[4-(3-pyridinyl)-1-imidazolyl]propyl]ammonium IUPAC Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxoethyl]-dimethyl-[3-(4-pyridin-3-ylimidazol-1-yl)propyl]azanium Traditional Name: [2-(2-cyanopyrrolidino)-2-keto-ethyl]-dimethyl-[3-[4-(3-pyridyl)imidazol-1-yl]propyl]ammonium Formula: C20H27N6O+ MolecularWeight: 367.46798

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCN1C=C(N=C1)C2=CN=CC=C2)CC(=O)N3CCCC3C#N

Isomeric SMILES

C[N+](C)(CCCN1C=C(N=C1)C2=CN=CC=C2)CC(=O)N3CCCC3C#N

InChI

InChI=1S/C20H27N6O/c1-26(2,15-20(27)25-10-4-7-18(25)12-21)11-5-9-24-14-19(23-16-24)17-6-3-8-22-13-17/h3,6,8,13-14,16,18H,4-5,7,9-11,15H2,1-2H3/q+1