1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexan-1-ol bromide

Systemtic Name: 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexan-1-ol bromide Openeye Name: 1-(2,3,3-trimethylindolin-1-ium-1-yl)hexan-1-ol bromide CAS Name: 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)-1-hexanol bromide IUPAC Name: 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexan-1-ol bromide Traditional Name: 1-(2,3,3-trimethylindolin-1-ium-1-yl)hexan-1-ol bromide Formula: C17H28BrNO MolecularWeight: 342.31432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC([NH+]1C(C(C2=CC=CC=C21)(C)C)C)O.[Br-]

Isomeric SMILES

CCCCCC([NH+]1C(C(C2=CC=CC=C21)(C)C)C)O.[Br-]

InChI

InChI=1S/C17H27NO.BrH/c1-5-6-7-12-16(19)18-13(2)17(3,4)14-10-8-9-11-15(14)18;/h8-11,13,16,19H,5-7,12H2,1-4H3;1H