bis(2-ethylhexyl) 4-methylbenzene-1,2-dicarboxylate

Systemtic Name: bis(2-ethylhexyl) 4-methylbenzene-1,2-dicarboxylate Openeye Name: bis(2-ethylhexyl) 4-methylbenzene-1,2-dicarboxylate CAS Name: 4-methylbenzene-1,2-dicarboxylic acid bis(2-ethylhexyl) ester IUPAC Name: bis(2-ethylhexyl) 4-methylbenzene-1,2-dicarboxylate Traditional Name: 4-methylbenzene-1,2-dicarboxylic acid bis(2-ethylhexyl) ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=C(C=C(C=C1)C)C(=O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(=O)C1=C(C=C(C=C1)C)C(=O)OCC(CC)CCCC

InChI

InChI=1S/C25H40O4/c1-6-10-12-20(8-3)17-28-24(26)22-15-14-19(5)16-23(22)25(27)29-18-21(9-4)13-11-7-2/h14-16,20-21H,6-13,17-18H2,1-5H3