(2-methoxy-3-octadecoxy-propyl) 2-(1-methylpiperidin-1-ium-1-yl)ethyl carbonate chloride

Systemtic Name: (2-methoxy-3-octadecoxy-propyl) 2-(1-methylpiperidin-1-ium-1-yl)ethyl carbonate chloride Openeye Name: (2-methoxy-3-octadecoxy-propyl) 2-(1-methylpiperidin-1-ium-1-yl)ethyl carbonate chloride CAS Name: carbonic acid (2-methoxy-3-octadecoxypropyl) 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester chloride IUPAC Name: (2-methoxy-3-octadecoxypropyl) 2-(1-methylpiperidin-1-ium-1-yl)ethyl carbonate chloride Traditional Name: carbonic acid (2-methoxy-3-stearyloxy-propyl) 2-(1-methylpiperidin-1-ium-1-yl)ethyl ester chloride Formula: C31H62ClNO5 MolecularWeight: 564.28068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COC(=O)OCC[N+]1(CCCCC1)C)OC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COC(=O)OCC[N+]1(CCCCC1)C)OC.[Cl-]

InChI

InChI=1S/C31H62NO5.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-35-28-30(34-3)29-37-31(33)36-27-25-32(2)23-20-19-21-24-32;/h30H,4-29H2,1-3H3;1H/q+1;/p-1