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

Systemtic Name: 4-chloranyl-2,2-diethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Openeye Name: 4-chloro-2,2-diethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide CAS Name: 4-chloro-2,2-diethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide IUPAC Name: 4-chloro-2,2-diethyl-9-phenyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Traditional Name: 4-chloro-2,2-diethyl-9-phenyl-1,3-dihydrobenz[f]isoindol-2-ium bromide Formula: C22H23BrClN MolecularWeight: 416.78172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN.BrH/c1-3-24(4-2)14-19-20(15-24)22(23)18-13-9-8-12-17(18)21(19)16-10-6-5-7-11-16;/h5-13H,3-4,14-15H2,1-2H3;1H/q+1;/p-1