[3-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]phenyl]-trimethyl-azanium bromide

Systemtic Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl]phenyl]-trimethyl-azanium bromide Openeye Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxo-propyl]phenyl]-trimethyl-ammonium bromide CAS Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]phenyl]-trimethylammonium bromide IUPAC Name: [3-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]phenyl]-trimethylazanium bromide Traditional Name: [3-[3-(3,4-dimethoxyphenyl)-3-keto-propyl]phenyl]-trimethyl-ammonium bromide Formula: C20H26BrNO3 MolecularWeight: 408.32934

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC(=C1)CCC(=O)C2=CC(=C(C=C2)OC)OC.[Br-]

Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)CCC(=O)C2=CC(=C(C=C2)OC)OC.[Br-]

InChI

InChI=1S/C20H26NO3.BrH/c1-21(2,3)17-8-6-7-15(13-17)9-11-18(22)16-10-12-19(23-4)20(14-16)24-5;/h6-8,10,12-14H,9,11H2,1-5H3;1H/q+1;/p-1