3-(icosanoylamino)propyl-dimethyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride

Systemtic Name: 3-(icosanoylamino)propyl-dimethyl-[(2-oxidanylidenepyrrolidin-1-yl)methyl]azanium chloride Openeye Name: 3-(icosanoylamino)propyl-dimethyl-[(2-oxopyrrolidin-1-yl)methyl]ammonium chloride CAS Name: dimethyl-[3-(1-oxoeicosylamino)propyl]-[(2-oxo-1-pyrrolidinyl)methyl]ammonium chloride IUPAC Name: 3-(icosanoylamino)propyl-dimethyl-[(2-oxopyrrolidin-1-yl)methyl]azanium chloride Traditional Name: 3-(eicosanoylamino)propyl-[(2-ketopyrrolidino)methyl]-dimethyl-ammonium chloride Formula: C30H60ClN3O2 MolecularWeight: 530.2693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CN1CCCC1=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CN1CCCC1=O.[Cl-]

InChI

InChI=1S/C30H59N3O2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29(34)31-25-22-27-33(2,3)28-32-26-21-24-30(32)35;/h4-28H2,1-3H3;1H