[2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-trimethyl-azanium bromide

Systemtic Name: [2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-trimethyl-azanium bromide Openeye Name: [2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]-trimethyl-ammonium bromide CAS Name: [2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-trimethylammonium bromide IUPAC Name: [2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-trimethylazanium bromide Traditional Name: [2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]-trimethyl-ammonium bromide Formula: C15H22BrNO3 MolecularWeight: 344.24408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1C(=O)C[N+](C)(C)C)OCCO2.[Br-]

Isomeric SMILES

CCC1=CC2=C(C=C1C(=O)C[N+](C)(C)C)OCCO2.[Br-]

InChI

InChI=1S/C15H22NO3.BrH/c1-5-11-8-14-15(19-7-6-18-14)9-12(11)13(17)10-16(2,3)4;/h8-9H,5-7,10H2,1-4H3;1H/q+1;/p-1