[11-[2-(hexadecoxymethyl)prop-2-enoxy]-11-oxidanylidene-undecyl]-trimethyl-azanium bromide

Systemtic Name: [11-[2-(hexadecoxymethyl)prop-2-enoxy]-11-oxidanylidene-undecyl]-trimethyl-azanium bromide Openeye Name: [11-[2-(hexadecoxymethyl)allyloxy]-11-oxo-undecyl]-trimethyl-ammonium bromide CAS Name: [11-[2-(hexadecoxymethyl)prop-2-enoxy]-11-oxoundecyl]-trimethylammonium bromide IUPAC Name: [11-[2-(hexadecoxymethyl)prop-2-enoxy]-11-oxoundecyl]-trimethylazanium bromide Traditional Name: [11-[2-(cetyloxymethyl)allyloxy]-11-keto-undecyl]-trimethyl-ammonium bromide Formula: C34H68BrNO3 MolecularWeight: 618.81262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(=C)COC(=O)CCCCCCCCCC[N+](C)(C)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(=C)COC(=O)CCCCCCCCCC[N+](C)(C)C.[Br-]

InChI

InChI=1S/C34H68NO3.BrH/c1-6-7-8-9-10-11-12-13-14-15-18-21-24-27-30-37-31-33(2)32-38-34(36)28-25-22-19-16-17-20-23-26-29-35(3,4)5;/h2,6-32H2,1,3-5H3;1H/q+1;/p-1