3-[1,3,3,3-tetrakis(bromanyl)propyl]-1,5-dihydro-2,4-benzodioxepine

Systemtic Name: 3-[1,3,3,3-tetrakis(bromanyl)propyl]-1,5-dihydro-2,4-benzodioxepine Openeye Name: 3-(1,3,3,3-tetrabromopropyl)-1,5-dihydro-2,4-benzodioxepine CAS Name: 3-(1,3,3,3-tetrabromopropyl)-1,5-dihydro-2,4-benzodioxepin IUPAC Name: 3-(1,3,3,3-tetrabromopropyl)-1,5-dihydro-2,4-benzodioxepine Traditional Name: 3-(1,3,3,3-tetrabromopropyl)-1,5-dihydro-2,4-benzodioxepin Formula: C12H12Br4O2 MolecularWeight: 507.83848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2COC(O1)C(CC(Br)(Br)Br)Br

Isomeric SMILES

C1C2=CC=CC=C2COC(O1)C(CC(Br)(Br)Br)Br

InChI

InChI=1S/C12H12Br4O2/c13-10(5-12(14,15)16)11-17-6-8-3-1-2-4-9(8)7-18-11/h1-4,10-11H,5-7H2