5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid

Systemtic Name: 5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid Openeye Name: 5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid CAS Name: 5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid IUPAC Name: 5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid Traditional Name: 5-(4-carboxyphenyl)cyclohexa-2,4-diene-1,1,2-tricarboxylic acid Formula: C16H12O8 MolecularWeight: 332.26168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O8/c17-12(18)9-3-1-8(2-4-9)10-5-6-11(13(19)20)16(7-10,14(21)22)15(23)24/h1-6H,7H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)