6-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexanoic acid bromide

Systemtic Name: 6-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexanoic acid bromide Openeye Name: 6-(2,3,3-trimethylindolin-1-ium-1-yl)hexanoic acid bromide CAS Name: 6-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexanoic acid bromide IUPAC Name: 6-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)hexanoic acid bromide Traditional Name: 6-(2,3,3-trimethylindolin-1-ium-1-yl)hexanoic acid bromide Formula: C17H26BrNO2 MolecularWeight: 356.29784

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=CC=CC=C2[NH+]1CCCCCC(=O)O)(C)C.[Br-]

Isomeric SMILES

CC1C(C2=CC=CC=C2[NH+]1CCCCCC(=O)O)(C)C.[Br-]

InChI

InChI=1S/C17H25NO2.BrH/c1-13-17(2,3)14-9-6-7-10-15(14)18(13)12-8-4-5-11-16(19)20;/h6-7,9-10,13H,4-5,8,11-12H2,1-3H3,(H,19,20);1H