2-[3-(2-hexyl-3-oxidanylidene-aziridin-1-yl)propyl-dimethyl-azaniumyl]ethanoate

Systemtic Name: 2-[3-(2-hexyl-3-oxidanylidene-aziridin-1-yl)propyl-dimethyl-azaniumyl]ethanoate Openeye Name: 2-[3-(2-hexyl-3-oxo-aziridin-1-yl)propyl-dimethyl-ammonio]acetate CAS Name: 2-[3-(2-hexyl-3-oxo-1-aziridinyl)propyl-dimethylammonio]acetate IUPAC Name: 2-[3-(2-hexyl-3-oxoaziridin-1-yl)propyl-dimethylazaniumyl]acetate Traditional Name: 2-[3-(2-hexyl-3-keto-ethylenimin-1-yl)propyl-dimethyl-ammonio]acetate Formula: C15H28N2O3 MolecularWeight: 284.39442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=O)N1CCC[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCCCCCC1C(=O)N1CCC[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C15H28N2O3/c1-4-5-6-7-9-13-15(20)16(13)10-8-11-17(2,3)12-14(18)19/h13H,4-12H2,1-3H3