5-(3-carboxy-4-oxidanyl-phenyl)carbonyloxybenzene-1,3-dicarboxylic acid; phthalic acid

Systemtic Name: 5-(3-carboxy-4-oxidanyl-phenyl)carbonyloxybenzene-1,3-dicarboxylic acid; phthalic acid Openeye Name: 5-(3-carboxy-4-hydroxy-benzoyl)oxybenzene-1,3-dicarboxylic acid; phthalic acid CAS Name: 5-[(3-carboxy-4-hydroxyphenyl)-oxomethoxy]benzene-1,3-dicarboxylic acid; phthalic acid IUPAC Name: 5-(3-carboxy-4-hydroxybenzoyl)oxybenzene-1,3-dicarboxylic acid; phthalic acid Traditional Name: 5-(3-carboxy-4-hydroxy-benzoyl)oxyisophthalic acid; phthalic acid Formula: C24H16O13 MolecularWeight: 512.37604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)C(=O)O.C1=CC(=C(C=C1C(=O)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)C(=O)O.C1=CC(=C(C=C1C(=O)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)C(=O)O)O

InChI

InChI=1S/C16H10O9.C8H6O4/c17-12-2-1-7(6-11(12)15(22)23)16(24)25-10-4-8(13(18)19)3-9(5-10)14(20)21;9-7(10)5-3-1-2-4-6(5)8(11)12/h1-6,17H,(H,18,19)(H,20,21)(H,22,23);1-4H,(H,9,10)(H,11,12)