[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-trimethyl-azanium bromide

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-trimethyl-azanium bromide Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-trimethyl-ammonium bromide CAS Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-trimethylammonium bromide IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-trimethylazanium bromide Traditional Name: [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-trimethyl-ammonium bromide Formula: C12H16BrNO3 MolecularWeight: 302.16434

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)C1=CC2=C(C=C1)OCO2.[Br-]

Isomeric SMILES

C[N+](C)(C)CC(=O)C1=CC2=C(C=C1)OCO2.[Br-]

InChI

InChI=1S/C12H16NO3.BrH/c1-13(2,3)7-10(14)9-4-5-11-12(6-9)16-8-15-11;/h4-6H,7-8H2,1-3H3;1H/q+1;/p-1