bis[2-(3,7-dimethylocta-1,6-dien-3-yloxy)-2-oxidanylidene-ethyl]-dimethyl-azanium bromide

Systemtic Name: bis[2-(3,7-dimethylocta-1,6-dien-3-yloxy)-2-oxidanylidene-ethyl]-dimethyl-azanium bromide Openeye Name: bis[2-(1,5-dimethyl-1-vinyl-hex-4-enoxy)-2-oxo-ethyl]-dimethyl-ammonium bromide CAS Name: bis[2-(3,7-dimethylocta-1,6-dien-3-yloxy)-2-oxoethyl]-dimethylammonium bromide IUPAC Name: bis[2-(3,7-dimethylocta-1,6-dien-3-yloxy)-2-oxoethyl]-dimethylazanium bromide Traditional Name: bis[2-(1,5-dimethyl-1-vinyl-hex-4-enoxy)-2-keto-ethyl]-dimethyl-ammonium bromide Formula: C26H44BrNO4 MolecularWeight: 514.53586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C=C)OC(=O)C[N+](C)(C)CC(=O)OC(C)(CCC=C(C)C)C=C)C.[Br-]

Isomeric SMILES

CC(=CCCC(C)(C=C)OC(=O)C[N+](C)(C)CC(=O)OC(C)(CCC=C(C)C)C=C)C.[Br-]

InChI

InChI=1S/C26H44NO4.BrH/c1-11-25(7,17-13-15-21(3)4)30-23(28)19-27(9,10)20-24(29)31-26(8,12-2)18-14-16-22(5)6;/h11-12,15-16H,1-2,13-14,17-20H2,3-10H3;1H/q+1;/p-1