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

Systemtic Name: 4-(phenylcarbonyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid Openeye Name: 4-benzoylcyclohexa-2,5-diene-1,1,2-tricarboxylic acid CAS Name: 4-benzoylcyclohexa-2,5-diene-1,1,2-tricarboxylic acid IUPAC Name: 4-benzoylcyclohexa-2,5-diene-1,1,2-tricarboxylic acid Traditional Name: 4-benzoylcyclohexa-2,5-diene-1,1,2-tricarboxylic acid Formula: C16H12O7 MolecularWeight: 316.26228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O7/c17-12(9-4-2-1-3-5-9)10-6-7-16(14(20)21,15(22)23)11(8-10)13(18)19/h1-8,10H,(H,18,19)(H,20,21)(H,22,23)