dimethyl-(2-oxidanylidenepropyl)-[(E)-3-phenylprop-2-enyl]azanium bromide

Systemtic Name: dimethyl-(2-oxidanylidenepropyl)-[(E)-3-phenylprop-2-enyl]azanium bromide Openeye Name: acetonyl-[(E)-cinnamyl]-dimethyl-ammonium bromide CAS Name: dimethyl-(2-oxopropyl)-[(E)-3-phenylprop-2-enyl]ammonium bromide IUPAC Name: dimethyl-(2-oxopropyl)-[(E)-3-phenylprop-2-enyl]azanium bromide Traditional Name: acetonyl-[(E)-cinnamyl]-dimethyl-ammonium bromide Formula: C14H20BrNO MolecularWeight: 298.2187

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20NO.BrH/c1-13(16)12-15(2,3)11-7-10-14-8-5-4-6-9-14;/h4-10H,11-12H2,1-3H3;1H/q+1;/p-1/b10-7+;