4-chloranyl-5-(4,5-dicarboxy-2-chloranyl-phenyl)carbonyl-phthalic acid

Systemtic Name: 4-chloranyl-5-(4,5-dicarboxy-2-chloranyl-phenyl)carbonyl-phthalic acid Openeye Name: 4-chloro-5-(4,5-dicarboxy-2-chloro-benzoyl)phthalic acid CAS Name: 4-chloro-5-[(4,5-dicarboxy-2-chlorophenyl)-oxomethyl]phthalic acid IUPAC Name: 4-chloro-5-(4,5-dicarboxy-2-chlorobenzoyl)phthalic acid Traditional Name: 4-chloro-5-(4,5-dicarboxy-2-chloro-benzoyl)phthalic acid Formula: C17H8Cl2O9 MolecularWeight: 427.14602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H8Cl2O9/c18-11-3-7(16(25)26)5(14(21)22)1-9(11)13(20)10-2-6(15(23)24)8(17(27)28)4-12(10)19/h1-4H,(H,21,22)(H,23,24)(H,25,26)(H,27,28)