4-chloranyl-2-ethyl-5-propyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-2-ethyl-5-propyl-pyrazole-3-carboxylic acid Openeye Name: 4-chloro-2-ethyl-5-propyl-pyrazole-3-carboxylic acid CAS Name: 4-chloro-2-ethyl-5-propyl-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-2-ethyl-5-propylpyrazole-3-carboxylic acid Traditional Name: 4-chloro-2-ethyl-5-propyl-pyrazole-3-carboxylic acid Formula: C9H13ClN2O2 MolecularWeight: 216.66472

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1Cl)C(=O)O)CC

Isomeric SMILES

CCCC1=NN(C(=C1Cl)C(=O)O)CC

InChI

InChI=1S/C9H13ClN2O2/c1-3-5-6-7(10)8(9(13)14)12(4-2)11-6/h3-5H2,1-2H3,(H,13,14)