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

Systemtic Name: 2-ethyl-5-phenyl-pyrazole-3-carboxylic acid Openeye Name: 2-ethyl-5-phenyl-pyrazole-3-carboxylic acid CAS Name: 2-ethyl-5-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 2-ethyl-5-phenylpyrazole-3-carboxylic acid Traditional Name: 2-ethyl-5-phenyl-pyrazole-3-carboxylic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCN1C(=CC(=N1)C2=CC=CC=C2)C(=O)O

InChI

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