bis(9-octyloctadecan-9-yl) benzene-1,2-dicarboxylate

Systemtic Name: bis(9-octyloctadecan-9-yl) benzene-1,2-dicarboxylate Openeye Name: bis(1,1-dioctyldecyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(9-octyloctadecan-9-yl) ester IUPAC Name: bis(9-octyloctadecan-9-yl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(1,1-dioctyldecyl) ester Formula: C60H110O4 MolecularWeight: 895.513

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCC)(CCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)OC(CCCCCCCC)(CCCCCCCC)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(CCCCCCCC)(CCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)OC(CCCCCCCC)(CCCCCCCC)CCCCCCCCC

InChI

InChI=1S/C60H110O4/c1-7-13-19-25-31-37-45-53-59(49-41-33-27-21-15-9-3,50-42-34-28-22-16-10-4)63-57(61)55-47-39-40-48-56(55)58(62)64-60(51-43-35-29-23-17-11-5,52-44-36-30-24-18-12-6)54-46-38-32-26-20-14-8-2/h39-40,47-48H,7-38,41-46,49-54H2,1-6H3