dioctadecan-9-yl benzene-1,2-dicarboxylate

Systemtic Name: dioctadecan-9-yl benzene-1,2-dicarboxylate Openeye Name: bis(1-octyldecyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid dioctadecan-9-yl ester IUPAC Name: dioctadecan-9-yl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(1-octyldecyl) ester Formula: C44H78O4 MolecularWeight: 671.08772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C44H78O4/c1-5-9-13-17-21-25-29-35-39(33-27-23-19-15-11-7-3)47-43(45)41-37-31-32-38-42(41)44(46)48-40(34-28-24-20-16-12-8-4)36-30-26-22-18-14-10-6-2/h31-32,37-40H,5-30,33-36H2,1-4H3