(E)-4-[dimethyl(octyl)azaniumyl]-2-methyl-pent-2-enoate bromide

Systemtic Name: (E)-4-[dimethyl(octyl)azaniumyl]-2-methyl-pent-2-enoate bromide Openeye Name: (E)-4-[dimethyl(octyl)ammonio]-2-methyl-pent-2-enoate bromide CAS Name: (E)-4-[dimethyl(octyl)ammonio]-2-methyl-2-pentenoate bromide IUPAC Name: (E)-4-[dimethyl(octyl)azaniumyl]-2-methylpent-2-enoate bromide Traditional Name: (E)-4-[dimethyl(octyl)ammonio]-2-methyl-pent-2-enoate bromide Formula: C16H31BrNO2- MolecularWeight: 349.32684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C)C(C)C=C(C)C(=O)[O-].[Br-]

Isomeric SMILES

CCCCCCCC[N+](C)(C)C(C)/C=C(\C)/C(=O)[O-].[Br-]

InChI

InChI=1S/C16H31NO2.BrH/c1-6-7-8-9-10-11-12-17(4,5)15(3)13-14(2)16(18)19;/h13,15H,6-12H2,1-5H3;1H/p-1/b14-13+;