bis[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-(1-adamantyl)benzene-1,2-dicarboxylate

Systemtic Name: bis[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-(1-adamantyl)benzene-1,2-dicarboxylate Openeye Name: bis[2-(4-bromophenyl)-2-oxo-ethyl] 4-(1-adamantyl)benzene-1,2-dicarboxylate CAS Name: 4-(1-adamantyl)benzene-1,2-dicarboxylic acid bis[2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: bis[2-(4-bromophenyl)-2-oxoethyl] 4-(1-adamantyl)benzene-1,2-dicarboxylate Traditional Name: 4-(1-adamantyl)benzene-1,2-dicarboxylic acid bis[2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C34H30Br2O6 MolecularWeight: 694.4064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)C(=O)OCC(=O)C5=CC=C(C=C5)Br)C(=O)OCC(=O)C6=CC=C(C=C6)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)C(=O)OCC(=O)C5=CC=C(C=C5)Br)C(=O)OCC(=O)C6=CC=C(C=C6)Br

InChI

InChI=1S/C34H30Br2O6/c35-26-6-1-23(2-7-26)30(37)18-41-32(39)28-10-5-25(34-15-20-11-21(16-34)13-22(12-20)17-34)14-29(28)33(40)42-19-31(38)24-3-8-27(36)9-4-24/h1-10,14,20-22H,11-13,15-19H2