4-[4-carboxylato-2-(3-oxidanidyl-3-oxidanylidene-propyl)phenyl]benzene-1,3-dicarboxylate

Systemtic Name: 4-[4-carboxylato-2-(3-oxidanidyl-3-oxidanylidene-propyl)phenyl]benzene-1,3-dicarboxylate Openeye Name: 4-[4-carboxylato-2-(3-oxido-3-oxo-propyl)phenyl]benzene-1,3-dicarboxylate CAS Name: 4-[4-carboxylato-2-(3-oxido-3-oxopropyl)phenyl]benzene-1,3-dicarboxylate IUPAC Name: 4-[4-carboxylato-2-(3-oxido-3-oxopropyl)phenyl]benzene-1,3-dicarboxylate Traditional Name: 4-[4-carboxylato-2-(3-keto-3-oxido-propyl)phenyl]isophthalate Formula: C18H10O8-4 MolecularWeight: 354.2672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])CCC(=O)[O-])C2=C(C=C(C=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])CCC(=O)[O-])C2=C(C=C(C=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H14O8/c19-15(20)6-3-9-7-10(16(21)22)1-4-12(9)13-5-2-11(17(23)24)8-14(13)18(25)26/h1-2,4-5,7-8H,3,6H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)/p-4