(3-hydroxyphenyl)methyl-dimethyl-prop-2-enyl-azanium bromide

Systemtic Name: (3-hydroxyphenyl)methyl-dimethyl-prop-2-enyl-azanium bromide Openeye Name: allyl-[(3-hydroxyphenyl)methyl]-dimethyl-ammonium bromide CAS Name: (3-hydroxyphenyl)methyl-dimethyl-prop-2-enylammonium bromide IUPAC Name: (3-hydroxyphenyl)methyl-dimethyl-prop-2-enylazanium bromide Traditional Name: allyl-(3-hydroxybenzyl)-dimethyl-ammonium bromide Formula: C12H18BrNO MolecularWeight: 272.18142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC=C)CC1=CC(=CC=C1)O.[Br-]

Isomeric SMILES

C[N+](C)(CC=C)CC1=CC(=CC=C1)O.[Br-]

InChI

InChI=1S/C12H17NO.BrH/c1-4-8-13(2,3)10-11-6-5-7-12(14)9-11;/h4-7,9H,1,8,10H2,2-3H3;1H