[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-[3-(5-ethyl-3-phenyl-pyrazol-1-yl)propyl]-dimethyl-azanium

Systemtic Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-[3-(5-ethyl-3-phenyl-pyrazol-1-yl)propyl]-dimethyl-azanium Openeye Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxo-ethyl]-[3-(5-ethyl-3-phenyl-pyrazol-1-yl)propyl]-dimethyl-ammonium CAS Name: [2-(2-cyano-1-pyrrolidinyl)-2-oxoethyl]-[3-(5-ethyl-3-phenyl-1-pyrazolyl)propyl]-dimethylammonium IUPAC Name: [2-(2-cyanopyrrolidin-1-yl)-2-oxoethyl]-[3-(5-ethyl-3-phenylpyrazol-1-yl)propyl]-dimethylazanium Traditional Name: [2-(2-cyanopyrrolidino)-2-keto-ethyl]-[3-(5-ethyl-3-phenyl-pyrazol-1-yl)propyl]-dimethyl-ammonium Formula: C23H32N5O+ MolecularWeight: 394.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1CCC[N+](C)(C)CC(=O)N2CCCC2C#N)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=NN1CCC[N+](C)(C)CC(=O)N2CCCC2C#N)C3=CC=CC=C3

InChI

InChI=1S/C23H32N5O/c1-4-20-16-22(19-10-6-5-7-11-19)25-27(20)14-9-15-28(2,3)18-23(29)26-13-8-12-21(26)17-24/h5-7,10-11,16,21H,4,8-9,12-15,18H2,1-3H3/q+1