2-methyl-2-prop-2-enyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide

Systemtic Name: 2-methyl-2-prop-2-enyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Openeye Name: 2-allyl-2-methyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide CAS Name: 2-methyl-2-prop-2-enyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide IUPAC Name: 2-methyl-2-prop-2-enyl-1,3-dihydrobenzo[f]isoindol-2-ium bromide Traditional Name: 2-allyl-2-methyl-1,3-dihydrobenz[f]isoindol-2-ium bromide Formula: C16H18BrN MolecularWeight: 304.22482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC2=CC3=CC=CC=C3C=C2C1)CC=C.[Br-]

Isomeric SMILES

C[N+]1(CC2=CC3=CC=CC=C3C=C2C1)CC=C.[Br-]

InChI

InChI=1S/C16H18N.BrH/c1-3-8-17(2)11-15-9-13-6-4-5-7-14(13)10-16(15)12-17;/h3-7,9-10H,1,8,11-12H2,2H3;1H/q+1;/p-1