4-chloranyl-2,5-diethyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-2,5-diethyl-pyrazole-3-carboxylic acid Openeye Name: 4-chloro-2,5-diethyl-pyrazole-3-carboxylic acid CAS Name: 4-chloro-2,5-diethyl-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-2,5-diethylpyrazole-3-carboxylic acid Traditional Name: 4-chloro-2,5-diethyl-pyrazole-3-carboxylic acid Formula: C8H11ClN2O2 MolecularWeight: 202.63814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1Cl)C(=O)O)CC

Isomeric SMILES

CCC1=NN(C(=C1Cl)C(=O)O)CC

InChI

InChI=1S/C8H11ClN2O2/c1-3-5-6(9)7(8(12)13)11(4-2)10-5/h3-4H2,1-2H3,(H,12,13)