4-[2-(3,4-dicarboxyphenyl)-1-oxidanylidene-propan-2-yl]phthalic acid

Systemtic Name: 4-[2-(3,4-dicarboxyphenyl)-1-oxidanylidene-propan-2-yl]phthalic acid Openeye Name: 4-[1-(3,4-dicarboxyphenyl)-1-methyl-2-oxo-ethyl]phthalic acid CAS Name: 4-[2-(3,4-dicarboxyphenyl)-1-oxopropan-2-yl]phthalic acid IUPAC Name: 4-[2-(3,4-dicarboxyphenyl)-1-oxopropan-2-yl]phthalic acid Traditional Name: 4-[1-(3,4-dicarboxyphenyl)-2-keto-1-methyl-ethyl]phthalic acid Formula: C19H14O9 MolecularWeight: 386.30906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)(C1=CC(=C(C=C1)C(=O)O)C(=O)O)C2=CC(=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(C=O)(C1=CC(=C(C=C1)C(=O)O)C(=O)O)C2=CC(=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H14O9/c1-19(8-20,9-2-4-11(15(21)22)13(6-9)17(25)26)10-3-5-12(16(23)24)14(7-10)18(27)28/h2-8H,1H3,(H,21,22)(H,23,24)(H,25,26)(H,27,28)