6,7,8-tris(bromanyl)-1,4,9-tributyl-dibenzo-p-dioxin-2,3-diol

Systemtic Name: 6,7,8-tris(bromanyl)-1,4,9-tributyl-dibenzo-p-dioxin-2,3-diol Openeye Name: 6,7,8-tribromo-1,4,9-tributyl-dibenzo-p-dioxin-2,3-diol CAS Name: 6,7,8-tribromo-1,4,9-tributyldibenzo-p-dioxin-2,3-diol IUPAC Name: 6,7,8-tribromo-1,4,9-tributyldibenzo-p-dioxin-2,3-diol Traditional Name: 6,7,8-tribromo-1,4,9-tributyl-dibenzo-p-dioxin-2,3-diol Formula: C24H29Br3O4 MolecularWeight: 621.19666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=C(C(=C1O)O)CCCC)OC3=C(C(=C(C(=C3O2)CCCC)Br)Br)Br

Isomeric SMILES

CCCCC1=C2C(=C(C(=C1O)O)CCCC)OC3=C(C(=C(C(=C3O2)CCCC)Br)Br)Br

InChI

InChI=1S/C24H29Br3O4/c1-4-7-10-13-16(25)17(26)18(27)24-21(13)30-22-14(11-8-5-2)19(28)20(29)15(12-9-6-3)23(22)31-24/h28-29H,4-12H2,1-3H3