bis[2-(bromomethyl)-2-adamantyl] adamantane-1,3-dicarboxylate

Systemtic Name: bis[2-(bromomethyl)-2-adamantyl] adamantane-1,3-dicarboxylate Openeye Name: bis[2-(bromomethyl)-2-adamantyl] adamantane-1,3-dicarboxylate CAS Name: adamantane-1,3-dicarboxylic acid bis[2-(bromomethyl)-2-adamantyl] ester IUPAC Name: bis[2-(bromomethyl)-2-adamantyl] adamantane-1,3-dicarboxylate Traditional Name: adamantane-1,3-dicarboxylic acid bis[2-(bromomethyl)-2-adamantyl] ester Formula: C34H46Br2O4 MolecularWeight: 678.53464

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(CBr)OC(=O)C45CC6CC(C4)CC(C6)(C5)C(=O)OC7(C8CC9CC(C8)CC7C9)CBr

Isomeric SMILES

C1C2CC3CC1CC(C2)C3(CBr)OC(=O)C45CC6CC(C4)CC(C6)(C5)C(=O)OC7(C8CC9CC(C8)CC7C9)CBr

InChI

InChI=1S/C34H46Br2O4/c35-17-33(25-4-19-1-20(6-25)7-26(33)5-19)39-29(37)31-12-23-3-24(13-31)15-32(14-23,16-31)30(38)40-34(18-36)27-8-21-2-22(10-27)11-28(34)9-21/h19-28H,1-18H2