3-(octadecanoylamino)propyl-[2-(2-oxidanylidenepyrrolidin-1-yl)propan-2-yl]azanium chloride

Systemtic Name: 3-(octadecanoylamino)propyl-[2-(2-oxidanylidenepyrrolidin-1-yl)propan-2-yl]azanium chloride Openeye Name: [1-methyl-1-(2-oxopyrrolidin-1-yl)ethyl]-[3-(octadecanoylamino)propyl]ammonium chloride CAS Name: 3-(1-oxooctadecylamino)propyl-[2-(2-oxo-1-pyrrolidinyl)propan-2-yl]ammonium chloride IUPAC Name: 3-(octadecanoylamino)propyl-[2-(2-oxopyrrolidin-1-yl)propan-2-yl]azanium chloride Traditional Name: [1-(2-ketopyrrolidino)-1-methyl-ethyl]-(3-stearamidopropyl)ammonium chloride Formula: C28H56ClN3O2 MolecularWeight: 502.21614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]C(C)(C)N1CCCC1=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]C(C)(C)N1CCCC1=O.[Cl-]

InChI

InChI=1S/C28H55N3O2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(32)29-23-20-24-30-28(2,3)31-25-19-22-27(31)33;/h30H,4-25H2,1-3H3,(H,29,32);1H