4-chloranyl-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide

Systemtic Name: 4-chloranyl-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Openeye Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide CAS Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide IUPAC Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Traditional Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenz[f]isoindol-2-ium bromide Formula: C20H19BrClN MolecularWeight: 388.72856

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2=C(C3=CC=CC=C3C(=C2C1)Cl)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

C[N+]1(CC2=C(C3=CC=CC=C3C(=C2C1)Cl)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C20H19ClN.BrH/c1-22(2)12-17-18(13-22)20(21)16-11-7-6-10-15(16)19(17)14-8-4-3-5-9-14;/h3-11H,12-13H2,1-2H3;1H/q+1;/p-1