1-(3-chlorophenyl)-3-ethyl-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-3-ethyl-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-ethyl-5-methyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-ethyl-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-ethyl-5-methylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-ethyl-5-methyl-pyrazole-4-carboxylic acid Formula: C13H13ClN2O2 MolecularWeight: 264.70752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O)C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O)C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H13ClN2O2/c1-3-11-12(13(17)18)8(2)16(15-11)10-6-4-5-9(14)7-10/h4-7H,3H2,1-2H3,(H,17,18)