1-(4-carboxy-2-chloranyl-phenyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-carboxy-2-chloranyl-phenyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-carboxy-2-chloro-phenyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-carboxy-2-chlorophenyl)-5-(2,6-dimethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-carboxy-2-chlorophenyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-carboxy-2-chloro-phenyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=C(C=C(C=C3)C(=O)O)Cl)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=C(C=C(C=C3)C(=O)O)Cl)C(=O)O

InChI

InChI=1S/C19H15ClN2O6/c1-27-15-4-3-5-16(28-2)17(15)14-9-12(19(25)26)21-22(14)13-7-6-10(18(23)24)8-11(13)20/h3-9H,1-2H3,(H,23,24)(H,25,26)