(4-acetyloxyphenyl)-dimethyl-prop-2-enyl-azanium bromide

Systemtic Name: (4-acetyloxyphenyl)-dimethyl-prop-2-enyl-azanium bromide Openeye Name: (4-acetoxyphenyl)-allyl-dimethyl-ammonium bromide CAS Name: (4-acetyloxyphenyl)-dimethyl-prop-2-enylammonium bromide IUPAC Name: (4-acetyloxyphenyl)-dimethyl-prop-2-enylazanium bromide Traditional Name: (4-acetoxyphenyl)-allyl-dimethyl-ammonium bromide Formula: C13H18BrNO2 MolecularWeight: 300.19152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)[N+](C)(C)CC=C.[Br-]

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)[N+](C)(C)CC=C.[Br-]

InChI

InChI=1S/C13H18NO2.BrH/c1-5-10-14(3,4)12-6-8-13(9-7-12)16-11(2)15;/h5-9H,1,10H2,2-4H3;1H/q+1;/p-1