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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]CN1CCCC1=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]CN1CCCC1=O.[Cl-]

InChI

InChI=1S/C30H59N3O2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29(34)32-26-22-25-31-28-33-27-21-24-30(33)35;/h31H,2-28H2,1H3,(H,32,34);1H