1-(3-chlorophenyl)-5-ethyl-3-phenethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-5-ethyl-3-phenethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-5-ethyl-3-phenethyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-5-ethyl-3-phenethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-5-ethyl-3-phenethylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-5-ethyl-3-phenethyl-pyrazole-4-carboxylic acid Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC(=CC=C2)Cl)CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC(=CC=C2)Cl)CCC3=CC=CC=C3)C(=O)O

InChI

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