4-(4-carboxy-3-oxidanyl-phenyl)benzene-1,2,3-tricarboxylic acid

Systemtic Name: 4-(4-carboxy-3-oxidanyl-phenyl)benzene-1,2,3-tricarboxylic acid Openeye Name: 4-(4-carboxy-3-hydroxy-phenyl)benzene-1,2,3-tricarboxylic acid CAS Name: 4-(4-carboxy-3-hydroxyphenyl)benzene-1,2,3-tricarboxylic acid IUPAC Name: 4-(4-carboxy-3-hydroxyphenyl)benzene-1,2,3-tricarboxylic acid Traditional Name: 4-(4-carboxy-3-hydroxy-phenyl)hemimellitic acid Formula: C16H10O9 MolecularWeight: 346.2452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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