2-(3-chlorophenyl)-4-methoxycarbonyl-pyrazole-3-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-4-methoxycarbonyl-pyrazole-3-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-4-methoxycarbonyl-pyrazole-3-carboxylic acid CAS Name: 2-(3-chlorophenyl)-4-methoxycarbonyl-3-pyrazolecarboxylic acid IUPAC Name: 2-(3-chlorophenyl)-4-methoxycarbonylpyrazole-3-carboxylic acid Traditional Name: 4-carbomethoxy-2-(3-chlorophenyl)pyrazole-3-carboxylic acid Formula: C12H9ClN2O4 MolecularWeight: 280.66386

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C12H9ClN2O4/c1-19-12(18)9-6-14-15(10(9)11(16)17)8-4-2-3-7(13)5-8/h2-6H,1H3,(H,16,17)