trimethyl-[6-[2-(octadecylcarbamoyloxymethyl)prop-2-enoxy]-6-oxidanylidene-hexyl]azanium

Systemtic Name: trimethyl-[6-[2-(octadecylcarbamoyloxymethyl)prop-2-enoxy]-6-oxidanylidene-hexyl]azanium Openeye Name: trimethyl-[6-[2-(octadecylcarbamoyloxymethyl)allyloxy]-6-oxo-hexyl]ammonium CAS Name: trimethyl-[6-[2-[[(octadecylamino)-oxomethoxy]methyl]prop-2-enoxy]-6-oxohexyl]ammonium IUPAC Name: trimethyl-[6-[2-(octadecylcarbamoyloxymethyl)prop-2-enoxy]-6-oxohexyl]azanium Traditional Name: [6-keto-6-[2-(stearylcarbamoyloxymethyl)allyloxy]hexyl]-trimethyl-ammonium Formula: C32H63N2O4+ MolecularWeight: 539.85362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCC[N+](C)(C)C

InChI

InChI=1S/C32H62N2O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-26-33-32(36)38-29-30(2)28-37-31(35)25-22-21-24-27-34(3,4)5/h2,6-29H2,1,3-5H3/p+1