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

Systemtic Name: 1,1'-biphenyl; 6-(4-carboxyphenyl)-3-oxidanyl-benzene-1,2,4-tricarboxylic acid Openeye Name: biphenyl; 6-(4-carboxyphenyl)-3-hydroxy-benzene-1,2,4-tricarboxylic acid CAS Name: 1,1'-biphenyl; 6-(4-carboxyphenyl)-3-hydroxybenzene-1,2,4-tricarboxylic acid IUPAC Name: 1,1'-biphenyl; 6-(4-carboxyphenyl)-3-hydroxybenzene-1,2,4-tricarboxylic acid Traditional Name: biphenyl; 6-(4-carboxyphenyl)-3-hydroxy-trimellitic acid Formula: C28H20O9 MolecularWeight: 500.453

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC(=CC=C1C2=CC(=C(C(=C2C(=O)O)C(=O)O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC(=CC=C1C2=CC(=C(C(=C2C(=O)O)C(=O)O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H10O9.C12H10/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;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-5,17H,(H,18,19)(H,20,21)(H,22,23)(H,24,25);1-10H