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

Systemtic Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-isobutyl-5-isopropyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-(2-methylpropyl)-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-isobutyl-5-isopropyl-pyrazole-4-carboxylic acid Formula: C17H21ClN2O2 MolecularWeight: 320.81384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN2O2/c1-10(2)8-14-15(17(21)22)16(11(3)4)20(19-14)13-7-5-6-12(18)9-13/h5-7,9-11H,8H2,1-4H3,(H,21,22)