dimethyl-(1-oxidanylidene-1-phenyl-pent-4-en-2-yl)-prop-2-enyl-azanium bromide

Systemtic Name: dimethyl-(1-oxidanylidene-1-phenyl-pent-4-en-2-yl)-prop-2-enyl-azanium bromide Openeye Name: allyl-(1-benzoylbut-3-enyl)-dimethyl-ammonium bromide CAS Name: dimethyl-(1-oxo-1-phenylpent-4-en-2-yl)-prop-2-enylammonium bromide IUPAC Name: dimethyl-(1-oxo-1-phenylpent-4-en-2-yl)-prop-2-enylazanium bromide Traditional Name: allyl-(1-benzoylbut-3-enyl)-dimethyl-ammonium bromide Formula: C16H22BrNO MolecularWeight: 324.25598

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC=C)C(CC=C)C(=O)C1=CC=CC=C1.[Br-]

Isomeric SMILES

C[N+](C)(CC=C)C(CC=C)C(=O)C1=CC=CC=C1.[Br-]

InChI

InChI=1S/C16H22NO.BrH/c1-5-10-15(17(3,4)13-6-2)16(18)14-11-8-7-9-12-14;/h5-9,11-12,15H,1-2,10,13H2,3-4H3;1H/q+1;/p-1