2-(1-decylpyridin-1-ium-4-yl)chromen-4-one bromide

Systemtic Name: 2-(1-decylpyridin-1-ium-4-yl)chromen-4-one bromide Openeye Name: 2-(1-decylpyridin-1-ium-4-yl)chromen-4-one bromide CAS Name: 2-(1-decyl-4-pyridin-1-iumyl)-1-benzopyran-4-one bromide IUPAC Name: 2-(1-decylpyridin-1-ium-4-yl)chromen-4-one bromide Traditional Name: 2-(1-decylpyridin-1-ium-4-yl)chromone bromide Formula: C24H30BrNO2 MolecularWeight: 444.4045

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2.[Br-]

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2.[Br-]

InChI

InChI=1S/C24H30NO2.BrH/c1-2-3-4-5-6-7-8-11-16-25-17-14-20(15-18-25)24-19-22(26)21-12-9-10-13-23(21)27-24;/h9-10,12-15,17-19H,2-8,11,16H2,1H3;1H/q+1;/p-1