2,4-bis(7-methyloctyl)benzene-1,3-dicarboxylate

Systemtic Name: 2,4-bis(7-methyloctyl)benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(7-methyloctyl)benzene-1,3-dicarboxylate CAS Name: 2,4-bis(7-methyloctyl)benzene-1,3-dicarboxylate IUPAC Name: 2,4-bis(7-methyloctyl)benzene-1,3-dicarboxylate Traditional Name: 2,4-bis(7-methyloctyl)isophthalate Formula: C26H40O4-2 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCC1=C(C(=C(C=C1)C(=O)[O-])CCCCCCC(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)CCCCCCC1=C(C(=C(C=C1)C(=O)[O-])CCCCCCC(C)C)C(=O)[O-]

InChI

InChI=1S/C26H42O4/c1-19(2)13-9-5-7-11-15-21-17-18-23(25(27)28)22(24(21)26(29)30)16-12-8-6-10-14-20(3)4/h17-20H,5-16H2,1-4H3,(H,27,28)(H,29,30)/p-2