5-chloranyl-3-ethyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-3-ethyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid Openeye Name: 5-chloro-3-ethyl-1-(o-tolyl)pyrazole-4-carboxylic acid CAS Name: 5-chloro-3-ethyl-1-(2-methylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-3-ethyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid Traditional Name: 5-chloro-3-ethyl-1-(o-tolyl)pyrazole-4-carboxylic acid Formula: C13H13ClN2O2 MolecularWeight: 264.70752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O)Cl)C2=CC=CC=C2C

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O)Cl)C2=CC=CC=C2C

InChI

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