1-(4-cyanophenyl)-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-5-methyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-cyanophenyl)-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-5-methylpyrazole-4-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-5-methyl-pyrazole-4-carboxylic acid Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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