dodecyl-dimethyl-[2-[(2Z)-2-methyl-6-methylidene-octa-2,7-dienoxy]-2-oxidanylidene-ethyl]azanium bromide

Systemtic Name: dodecyl-dimethyl-[2-[(2Z)-2-methyl-6-methylidene-octa-2,7-dienoxy]-2-oxidanylidene-ethyl]azanium bromide Openeye Name: dodecyl-dimethyl-[2-[(2Z)-2-methyl-6-methylene-octa-2,7-dienoxy]-2-oxo-ethyl]ammonium bromide CAS Name: dodecyl-dimethyl-[2-[(2Z)-2-methyl-6-methyleneocta-2,7-dienoxy]-2-oxoethyl]ammonium bromide IUPAC Name: dodecyl-dimethyl-[2-[(2Z)-2-methyl-6-methylideneocta-2,7-dienoxy]-2-oxoethyl]azanium bromide Traditional Name: [2-keto-2-[(2Z)-2-methyl-6-methylene-octa-2,7-dienoxy]ethyl]-lauryl-dimethyl-ammonium bromide Formula: C26H48BrNO2 MolecularWeight: 486.56882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CC(=O)OCC(=CCCC(=C)C=C)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CC(=O)OC/C(=C\CCC(=C)C=C)/C.[Br-]

InChI

InChI=1S/C26H48NO2.BrH/c1-7-9-10-11-12-13-14-15-16-17-21-27(5,6)22-26(28)29-23-25(4)20-18-19-24(3)8-2;/h8,20H,2-3,7,9-19,21-23H2,1,4-6H3;1H/q+1;/p-1/b25-20-;