5,6,7,8-tetrakis(bromanyl)-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 5,6,7,8-tetrakis(bromanyl)-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxine Openeye Name: 5,6,7,8-tetrabromo-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxine CAS Name: 5,6,7,8-tetrabromo-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxin IUPAC Name: 5,6,7,8-tetrabromo-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxine Traditional Name: 5,6,7,8-tetrabromo-3-phenyl-2-(2-phenylethynyl)-2,3-dihydro-1,4-benzodioxin Formula: C22H12Br4O2 MolecularWeight: 627.94548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2C(OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C#CC2C(OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H12Br4O2/c23-16-17(24)19(26)22-21(18(16)25)27-15(12-11-13-7-3-1-4-8-13)20(28-22)14-9-5-2-6-10-14/h1-10,15,20H