[2-methyl-3-(4-methyl-3-oxidanylidene-pent-4-en-2-yl)nonan-2-yl]azanium bromide

Systemtic Name: [2-methyl-3-(4-methyl-3-oxidanylidene-pent-4-en-2-yl)nonan-2-yl]azanium bromide Openeye Name: [2-(1,3-dimethyl-2-oxo-but-3-enyl)-1,1-dimethyl-octyl]ammonium bromide CAS Name: [2-methyl-3-(4-methyl-3-oxopent-4-en-2-yl)nonan-2-yl]ammonium bromide IUPAC Name: [2-methyl-3-(4-methyl-3-oxopent-4-en-2-yl)nonan-2-yl]azanium bromide Traditional Name: (2-hexyl-4-keto-1,1,3,5-tetramethyl-hex-5-enyl)ammonium bromide Formula: C16H32BrNO MolecularWeight: 334.33538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)C(=O)C(=C)C)C(C)(C)[NH3+].[Br-]

Isomeric SMILES

CCCCCCC(C(C)C(=O)C(=C)C)C(C)(C)[NH3+].[Br-]

InChI

InChI=1S/C16H31NO.BrH/c1-7-8-9-10-11-14(16(5,6)17)13(4)15(18)12(2)3;/h13-14H,2,7-11,17H2,1,3-6H3;1H