bis(3-ethylheptyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(3-ethylheptyl) benzene-1,2-dicarboxylate Openeye Name: bis(3-ethylheptyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(3-ethylheptyl) ester IUPAC Name: bis(3-ethylheptyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(3-ethylheptyl) ester Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(CC)CCCC

InChI

InChI=1S/C26H42O4/c1-5-9-13-21(7-3)17-19-29-25(27)23-15-11-12-16-24(23)26(28)30-20-18-22(8-4)14-10-6-2/h11-12,15-16,21-22H,5-10,13-14,17-20H2,1-4H3