5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid

Systemtic Name: 5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid Openeye Name: 5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid CAS Name: 5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid IUPAC Name: 5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid Traditional Name: 5-[2-(4-chlorophenyl)ethyl]-1H-pyrazole-3-carboxylic acid Formula: C12H11ClN2O2 MolecularWeight: 250.68094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CC(=NN2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC2=CC(=NN2)C(=O)O)Cl

InChI

InChI=1S/C12H11ClN2O2/c13-9-4-1-8(2-5-9)3-6-10-7-11(12(16)17)15-14-10/h1-2,4-5,7H,3,6H2,(H,14,15)(H,16,17)