[1-morpholin-4-ium-4-yl-3-(2-oxidanylidenepyrrolidin-1-yl)propan-2-yl] dodecanoate chloride

Systemtic Name: [1-morpholin-4-ium-4-yl-3-(2-oxidanylidenepyrrolidin-1-yl)propan-2-yl] dodecanoate chloride Openeye Name: [1-(morpholin-4-ium-4-ylmethyl)-2-(2-oxopyrrolidin-1-yl)ethyl] dodecanoate chloride CAS Name: dodecanoic acid [1-(4-morpholin-4-iumyl)-3-(2-oxo-1-pyrrolidinyl)propan-2-yl] ester chloride IUPAC Name: [1-morpholin-4-ium-4-yl-3-(2-oxopyrrolidin-1-yl)propan-2-yl] dodecanoate chloride Traditional Name: lauric acid [1-[(2-ketopyrrolidino)methyl]-2-morpholin-4-ium-4-yl-ethyl] ester chloride Formula: C23H43ClN2O4 MolecularWeight: 447.05152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(C[NH+]1CCOCC1)CN2CCCC2=O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(C[NH+]1CCOCC1)CN2CCCC2=O.[Cl-]

InChI

InChI=1S/C23H42N2O4.ClH/c1-2-3-4-5-6-7-8-9-10-13-23(27)29-21(19-24-15-17-28-18-16-24)20-25-14-11-12-22(25)26;/h21H,2-20H2,1H3;1H