bis(4-methylpentyl) 5-(oxan-2-yloxymethyl)benzene-1,3-dicarboxylate

Systemtic Name: bis(4-methylpentyl) 5-(oxan-2-yloxymethyl)benzene-1,3-dicarboxylate Openeye Name: diisohexyl 5-(tetrahydropyran-2-yloxymethyl)benzene-1,3-dicarboxylate CAS Name: 5-(2-oxanyloxymethyl)benzene-1,3-dicarboxylic acid bis(4-methylpentyl) ester IUPAC Name: bis(4-methylpentyl) 5-(oxan-2-yloxymethyl)benzene-1,3-dicarboxylate Traditional Name: 5-(tetrahydropyran-2-yloxymethyl)benzene-1,3-dicarboxylic acid diisohexyl ester Formula: C26H40O6 MolecularWeight: 448.5922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=CC(=CC(=C1)COC2CCCCO2)C(=O)OCCCC(C)C

Isomeric SMILES

CC(C)CCCOC(=O)C1=CC(=CC(=C1)COC2CCCCO2)C(=O)OCCCC(C)C

InChI

InChI=1S/C26H40O6/c1-19(2)9-7-13-30-25(27)22-15-21(18-32-24-11-5-6-12-29-24)16-23(17-22)26(28)31-14-8-10-20(3)4/h15-17,19-20,24H,5-14,18H2,1-4H3