bis[3,4,6-tris(bromanyl)-2-hexoxycarbonyl-phenyl] ethanedioate

Systemtic Name: bis[3,4,6-tris(bromanyl)-2-hexoxycarbonyl-phenyl] ethanedioate Openeye Name: bis(3,4,6-tribromo-2-hexoxycarbonyl-phenyl) oxalate CAS Name: oxalic acid bis[3,4,6-tribromo-2-[hexoxy(oxo)methyl]phenyl] ester IUPAC Name: bis(3,4,6-tribromo-2-hexoxycarbonylphenyl) oxalate Traditional Name: oxalic acid bis(3,4,6-tribromo-2-hexoxycarbonyl-phenyl) ester Formula: C28H28Br6O8 MolecularWeight: 971.94112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(C(=CC(=C1Br)Br)Br)OC(=O)C(=O)OC2=C(C(=C(C=C2Br)Br)Br)C(=O)OCCCCCC

Isomeric SMILES

CCCCCCOC(=O)C1=C(C(=CC(=C1Br)Br)Br)OC(=O)C(=O)OC2=C(C(=C(C=C2Br)Br)Br)C(=O)OCCCCCC

InChI

InChI=1S/C28H28Br6O8/c1-3-5-7-9-11-39-25(35)19-21(33)15(29)13-17(31)23(19)41-27(37)28(38)42-24-18(32)14-16(30)22(34)20(24)26(36)40-12-10-8-6-4-2/h13-14H,3-12H2,1-2H3