[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium bromide

Systemtic Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium bromide Openeye Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hydroxy-4-oxo-butyl]-trimethyl-ammonium bromide CAS Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hydroxy-4-oxobutyl]-trimethylammonium bromide IUPAC Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hydroxy-4-oxobutyl]-trimethylazanium bromide Traditional Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hydroxy-4-keto-butyl]-trimethyl-ammonium bromide Formula: C17H32BrNO3 MolecularWeight: 378.34488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=CCC/C(=C/COC(=O)CCC([N+](C)(C)C)O)/C)C.[Br-]

InChI

InChI=1S/C17H32NO3.BrH/c1-14(2)8-7-9-15(3)12-13-21-17(20)11-10-16(19)18(4,5)6;/h8,12,16,19H,7,9-11,13H2,1-6H3;1H/q+1;/p-1/b15-12+;