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

Systemtic Name: 1-(3-chlorophenyl)-3-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-isopropyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-isopropyl-pyrazole-4-carboxylic acid Formula: C13H13ClN2O2 MolecularWeight: 264.70752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C1C(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)C1=NN(C=C1C(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H13ClN2O2/c1-8(2)12-11(13(17)18)7-16(15-12)10-5-3-4-9(14)6-10/h3-8H,1-2H3,(H,17,18)