dimethyl-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethyl]-octyl-azanium bromide

Systemtic Name: dimethyl-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethyl]-octyl-azanium bromide Openeye Name: dimethyl-[2-(4-methyl-2-oxo-chromen-7-yl)oxyethyl]-octyl-ammonium bromide CAS Name: dimethyl-[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]ethyl]-octylammonium bromide IUPAC Name: dimethyl-[2-(4-methyl-2-oxochromen-7-yl)oxyethyl]-octylazanium bromide Traditional Name: 2-(2-keto-4-methyl-chromen-7-yl)oxyethyl-dimethyl-octyl-ammonium bromide Formula: C22H34BrNO3 MolecularWeight: 440.41426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C)CCOC1=CC2=C(C=C1)C(=CC(=O)O2)C.[Br-]

Isomeric SMILES

CCCCCCCC[N+](C)(C)CCOC1=CC2=C(C=C1)C(=CC(=O)O2)C.[Br-]

InChI

InChI=1S/C22H34NO3.BrH/c1-5-6-7-8-9-10-13-23(3,4)14-15-25-19-11-12-20-18(2)16-22(24)26-21(20)17-19;/h11-12,16-17H,5-10,13-15H2,1-4H3;1H/q+1;/p-1