1-(3-chlorophenyl)-3-(2-methylpropyl)-5-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-isobutyl-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-isobutyl-5-phenyl-pyrazole-4-carboxylic acid Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H19ClN2O2/c1-13(2)11-17-18(20(24)25)19(14-7-4-3-5-8-14)23(22-17)16-10-6-9-15(21)12-16/h3-10,12-13H,11H2,1-2H3,(H,24,25)