2-ethyl-1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)pentan-1-one bromide

Systemtic Name: 2-ethyl-1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)pentan-1-one bromide Openeye Name: 2-ethyl-1-(2,3,3-trimethylindolin-1-ium-1-yl)pentan-1-one bromide CAS Name: 2-ethyl-1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)-1-pentanone bromide IUPAC Name: 2-ethyl-1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)pentan-1-one bromide Traditional Name: 2-ethyl-1-(2,3,3-trimethylindolin-1-ium-1-yl)pentan-1-one bromide Formula: C18H28BrNO MolecularWeight: 354.32502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO.BrH/c1-6-10-14(7-2)17(20)19-13(3)18(4,5)15-11-8-9-12-16(15)19;/h8-9,11-14H,6-7,10H2,1-5H3;1H