4,5-bis(chloranyl)-2,2-dimethyl-1,3-dihydroisoindol-2-ium bromide

Systemtic Name: 4,5-bis(chloranyl)-2,2-dimethyl-1,3-dihydroisoindol-2-ium bromide Openeye Name: 4,5-dichloro-2,2-dimethyl-isoindolin-2-ium bromide CAS Name: 4,5-dichloro-2,2-dimethyl-1,3-dihydroisoindol-2-ium bromide IUPAC Name: 4,5-dichloro-2,2-dimethyl-1,3-dihydroisoindol-2-ium bromide Traditional Name: 4,5-dichloro-2,2-dimethyl-isoindolin-2-ium bromide Formula: C10H12BrCl2N MolecularWeight: 297.01898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2=C(C1)C(=C(C=C2)Cl)Cl)C.[Br-]

Isomeric SMILES

C[N+]1(CC2=C(C1)C(=C(C=C2)Cl)Cl)C.[Br-]

InChI

InChI=1S/C10H12Cl2N.BrH/c1-13(2)5-7-3-4-9(11)10(12)8(7)6-13;/h3-4H,5-6H2,1-2H3;1H/q+1;/p-1