2-[1-(2-diethylaminoethyl)pyrrolidin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[1-(2-diethylaminoethyl)pyrrolidin-1-ium-1-yl]ethanoate Openeye Name: 2-[1-(2-diethylaminoethyl)pyrrolidin-1-ium-1-yl]acetate CAS Name: 2-[1-(2-diethylaminoethyl)-1-pyrrolidin-1-iumyl]acetate IUPAC Name: 2-[1-(2-diethylaminoethyl)pyrrolidin-1-ium-1-yl]acetate Traditional Name: 2-[1-(2-diethylaminoethyl)pyrrolidin-1-ium-1-yl]acetate Formula: C12H24N2O2 MolecularWeight: 228.33116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1(CCCC1)CC(=O)[O-]

Isomeric SMILES

CCN(CC)CC[N+]1(CCCC1)CC(=O)[O-]

InChI

InChI=1S/C12H24N2O2/c1-3-13(4-2)7-10-14(11-12(15)16)8-5-6-9-14/h3-11H2,1-2H3