6-(4-carboxyphenyl)-3-oxidanyl-benzene-1,2,4-tricarboxylic acid

Systemtic Name: 6-(4-carboxyphenyl)-3-oxidanyl-benzene-1,2,4-tricarboxylic acid Openeye Name: 6-(4-carboxyphenyl)-3-hydroxy-benzene-1,2,4-tricarboxylic acid CAS Name: 6-(4-carboxyphenyl)-3-hydroxybenzene-1,2,4-tricarboxylic acid IUPAC Name: 6-(4-carboxyphenyl)-3-hydroxybenzene-1,2,4-tricarboxylic acid Traditional Name: 6-(4-carboxyphenyl)-3-hydroxy-trimellitic acid Formula: C16H10O9 MolecularWeight: 346.2452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C(=C2C(=O)O)C(=O)O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C(=C2C(=O)O)C(=O)O)O)C(=O)O)C(=O)O

InChI

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