5-chloranyl-1-(4-methylphenyl)-3-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-1-(4-methylphenyl)-3-propyl-pyrazole-4-carboxylic acid Openeye Name: 5-chloro-3-propyl-1-(p-tolyl)pyrazole-4-carboxylic acid CAS Name: 5-chloro-1-(4-methylphenyl)-3-propyl-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-1-(4-methylphenyl)-3-propylpyrazole-4-carboxylic acid Traditional Name: 5-chloro-3-propyl-1-(p-tolyl)pyrazole-4-carboxylic acid Formula: C14H15ClN2O2 MolecularWeight: 278.7341

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)O)Cl)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)O)Cl)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H15ClN2O2/c1-3-4-11-12(14(18)19)13(15)17(16-11)10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3,(H,18,19)