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

Systemtic Name: 4-chloranyl-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium iodide Openeye Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium iodide CAS Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium iodide IUPAC Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium iodide Traditional Name: 4-chloro-2,2-dimethyl-9-phenyl-1,3-dihydrobenz[f]isoindol-2-ium iodide Formula: C20H19ClIN MolecularWeight: 435.72903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN.HI/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