1-[4-(carboxymethyloxy)-3-cyano-phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[4-(carboxymethyloxy)-3-cyano-phenyl]pyrazole-4-carboxylic acid Openeye Name: 1-[4-(carboxymethyloxy)-3-cyano-phenyl]pyrazole-4-carboxylic acid CAS Name: 1-[4-(carboxymethyloxy)-3-cyanophenyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(carboxymethyloxy)-3-cyanophenyl]pyrazole-4-carboxylic acid Traditional Name: 1-[4-(carboxymethyloxy)-3-cyano-phenyl]pyrazole-4-carboxylic acid Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C=C(C=N2)C(=O)O)C#N)OCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N2C=C(C=N2)C(=O)O)C#N)OCC(=O)O

InChI

InChI=1S/C13H9N3O5/c14-4-8-3-10(1-2-11(8)21-7-12(17)18)16-6-9(5-15-16)13(19)20/h1-3,5-6H,7H2,(H,17,18)(H,19,20)