4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate

Systemtic Name: 4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate Openeye Name: 4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate CAS Name: 4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate IUPAC Name: 4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate Traditional Name: 4-[6-(3,4-dicarboxylatophenoxy)hexoxy]phthalate Formula: C22H18O10-4 MolecularWeight: 442.37232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCCCCCCOC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OCCCCCCOC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H22O10/c23-19(24)15-7-5-13(11-17(15)21(27)28)31-9-3-1-2-4-10-32-14-6-8-16(20(25)26)18(12-14)22(29)30/h5-8,11-12H,1-4,9-10H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)/p-4