1-(3-chlorophenyl)-5-(2-methylpropyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-5-(2-methylpropyl)pyrazole-3-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-5-isobutyl-pyrazole-3-carboxylic acid CAS Name: 1-(3-chlorophenyl)-5-(2-methylpropyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-5-(2-methylpropyl)pyrazole-3-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-5-isobutyl-pyrazole-3-carboxylic acid Formula: C14H15ClN2O2 MolecularWeight: 278.7341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1C2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)CC1=CC(=NN1C2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C14H15ClN2O2/c1-9(2)6-12-8-13(14(18)19)16-17(12)11-5-3-4-10(15)7-11/h3-5,7-9H,6H2,1-2H3,(H,18,19)