bis(2-ethylheptyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(2-ethylheptyl) benzene-1,2-dicarboxylate Openeye Name: bis(2-ethylheptyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(2-ethylheptyl) ester IUPAC Name: bis(2-ethylheptyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(2-ethylheptyl) ester Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCCC

Isomeric SMILES

CCCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCCC

InChI

InChI=1S/C26H42O4/c1-5-9-11-15-21(7-3)19-29-25(27)23-17-13-14-18-24(23)26(28)30-20-22(8-4)16-12-10-6-2/h13-14,17-18,21-22H,5-12,15-16,19-20H2,1-4H3