[3-(3-methoxyphenyl)-3-oxidanylidene-propyl]-trimethyl-azanium bromide

Systemtic Name: [3-(3-methoxyphenyl)-3-oxidanylidene-propyl]-trimethyl-azanium bromide Openeye Name: [3-(3-methoxyphenyl)-3-oxo-propyl]-trimethyl-ammonium bromide CAS Name: [3-(3-methoxyphenyl)-3-oxopropyl]-trimethylammonium bromide IUPAC Name: [3-(3-methoxyphenyl)-3-oxopropyl]-trimethylazanium bromide Traditional Name: [3-keto-3-(3-methoxyphenyl)propyl]-trimethyl-ammonium bromide Formula: C13H20BrNO2 MolecularWeight: 302.2074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20NO2.BrH/c1-14(2,3)9-8-13(15)11-6-5-7-12(10-11)16-4;/h5-7,10H,8-9H2,1-4H3;1H/q+1;/p-1