1-(3-cyanophenyl)-5-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-cyanophenyl)-5-methyl-pyrazole-3-carboxylic acid Openeye Name: 1-(3-cyanophenyl)-5-methyl-pyrazole-3-carboxylic acid CAS Name: 1-(3-cyanophenyl)-5-methyl-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-cyanophenyl)-5-methylpyrazole-3-carboxylic acid Traditional Name: 1-(3-cyanophenyl)-5-methyl-pyrazole-3-carboxylic acid Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC(=C2)C#N)C(=O)O

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC(=C2)C#N)C(=O)O

InChI

InChI=1S/C12H9N3O2/c1-8-5-11(12(16)17)14-15(8)10-4-2-3-9(6-10)7-13/h2-6H,1H3,(H,16,17)