5-ethyl-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-ethyl-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 5-ethyl-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 5-ethyl-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-1-phenylpyrazole-3-carboxylic acid Traditional Name: 5-ethyl-1-phenyl-pyrazole-3-carboxylic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC1=CC(=NN1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H12N2O2/c1-2-9-8-11(12(15)16)13-14(9)10-6-4-3-5-7-10/h3-8H,2H2,1H3,(H,15,16)