4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid

Systemtic Name: 4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid Openeye Name: 4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid CAS Name: 4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid IUPAC Name: 4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid Traditional Name: 4-(3-carboxyphenyl)cyclohexa-2,5-diene-1,1,2-tricarboxylic acid Formula: C16H12O8 MolecularWeight: 332.26168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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