2-[2-carboxy-4,6-bis(chloranyl)phenyl]-3-oxidanylidene-1H-pyrazole-5-carboxylic acid

Systemtic Name: 2-[2-carboxy-4,6-bis(chloranyl)phenyl]-3-oxidanylidene-1H-pyrazole-5-carboxylic acid Openeye Name: 2-(2-carboxy-4,6-dichloro-phenyl)-3-oxo-1H-pyrazole-5-carboxylic acid CAS Name: 2-(2-carboxy-4,6-dichlorophenyl)-3-oxo-1H-pyrazole-5-carboxylic acid IUPAC Name: 2-(2-carboxy-4,6-dichlorophenyl)-3-oxo-1H-pyrazole-5-carboxylic acid Traditional Name: 1-(2-carboxy-4,6-dichloro-phenyl)-5-keto-3-pyrazoline-3-carboxylic acid Formula: C11H6Cl2N2O5 MolecularWeight: 317.08174

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(=O)C=C(N2)C(=O)O)C(=O)O)Cl

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(=O)C=C(N2)C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C11H6Cl2N2O5/c12-4-1-5(10(17)18)9(6(13)2-4)15-8(16)3-7(14-15)11(19)20/h1-3,14H,(H,17,18)(H,19,20)