2,2,5-trimethyl-1,3-dihydroisoindol-2-ium bromide

Systemtic Name: 2,2,5-trimethyl-1,3-dihydroisoindol-2-ium bromide Openeye Name: 2,2,5-trimethylisoindolin-2-ium bromide CAS Name: 2,2,5-trimethyl-1,3-dihydroisoindol-2-ium bromide IUPAC Name: 2,2,5-trimethyl-1,3-dihydroisoindol-2-ium bromide Traditional Name: 2,2,5-trimethylisoindolin-2-ium bromide Formula: C11H16BrN MolecularWeight: 242.15544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C[N+](C2)(C)C)C=C1.[Br-]

Isomeric SMILES

CC1=CC2=C(C[N+](C2)(C)C)C=C1.[Br-]

InChI

InChI=1S/C11H16N.BrH/c1-9-4-5-10-7-12(2,3)8-11(10)6-9;/h4-6H,7-8H2,1-3H3;1H/q+1;/p-1