2-(12-carboxylato-13-oxidanidyl-13-oxidanylidene-tridecyl)terephthalate

Systemtic Name: 2-(12-carboxylato-13-oxidanidyl-13-oxidanylidene-tridecyl)terephthalate Openeye Name: 2-(12-carboxylato-13-oxido-13-oxo-tridecyl)terephthalate CAS Name: 2-(12-carboxylato-13-oxido-13-oxotridecyl)terephthalate IUPAC Name: 2-(12-carboxylato-13-oxido-13-oxotridecyl)terephthalate Traditional Name: 2-(12-carboxylato-13-keto-13-oxido-tridecyl)terephthalate Formula: C22H26O8-4 MolecularWeight: 418.43704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])CCCCCCCCCCCC(C(=O)[O-])C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])CCCCCCCCCCCC(C(=O)[O-])C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H30O8/c23-19(24)16-12-13-17(20(25)26)15(14-16)10-8-6-4-2-1-3-5-7-9-11-18(21(27)28)22(29)30/h12-14,18H,1-11H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)/p-4