2,4-dihexyl-5-oxidanyl-benzene-1,3-dicarboxylate

Systemtic Name: 2,4-dihexyl-5-oxidanyl-benzene-1,3-dicarboxylate Openeye Name: 2,4-dihexyl-5-hydroxy-benzene-1,3-dicarboxylate CAS Name: 2,4-dihexyl-5-hydroxybenzene-1,3-dicarboxylate IUPAC Name: 2,4-dihexyl-5-hydroxybenzene-1,3-dicarboxylate Traditional Name: 2,4-dihexyl-5-hydroxy-isophthalate Formula: C20H28O5-2 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C=C1C(=O)[O-])O)CCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCC1=C(C(=C(C=C1C(=O)[O-])O)CCCCCC)C(=O)[O-]

InChI

InChI=1S/C20H30O5/c1-3-5-7-9-11-14-16(19(22)23)13-17(21)15(18(14)20(24)25)12-10-8-6-4-2/h13,21H,3-12H2,1-2H3,(H,22,23)(H,24,25)/p-2