[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-[2-(1-methyl-2-phenyl-imidazol-4-yl)ethyl]azanium

Systemtic Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-dimethyl-[2-(1-methyl-2-phenyl-imidazol-4-yl)ethyl]azanium Openeye Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxo-ethyl]-dimethyl-[2-(1-methyl-2-phenyl-imidazol-4-yl)ethyl]ammonium CAS Name: [2-(2-cyano-1-pyrrolidinyl)-2-oxoethyl]-dimethyl-[2-(1-methyl-2-phenyl-4-imidazolyl)ethyl]ammonium IUPAC Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxoethyl]-dimethyl-[2-(1-methyl-2-phenylimidazol-4-yl)ethyl]azanium Traditional Name: [2-(2-cyanopyrrolidino)-2-keto-ethyl]-dimethyl-[2-(1-methyl-2-phenyl-imidazol-4-yl)ethyl]ammonium Formula: C21H28N5O+ MolecularWeight: 366.47992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC=CC=C2)CC[N+](C)(C)CC(=O)N3CCCC3C#N

Isomeric SMILES

CN1C=C(N=C1C2=CC=CC=C2)CC[N+](C)(C)CC(=O)N3CCCC3C#N

InChI

InChI=1S/C21H28N5O/c1-24-15-18(23-21(24)17-8-5-4-6-9-17)11-13-26(2,3)16-20(27)25-12-7-10-19(25)14-22/h4-6,8-9,15,19H,7,10-13,16H2,1-3H3/q+1