2-[1-(3-chloranyl-4-fluoranyl-phenyl)-4-phenyl-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(3-chloranyl-4-fluoranyl-phenyl)-4-phenyl-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[1-(3-chloro-4-fluoro-phenyl)-4-phenyl-pyrazol-3-yl]acetic acid CAS Name: 2-[1-(3-chloro-4-fluorophenyl)-4-phenyl-3-pyrazolyl]acetic acid IUPAC Name: 2-[1-(3-chloro-4-fluorophenyl)-4-phenylpyrazol-3-yl]acetic acid Traditional Name: 2-[1-(3-chloro-4-fluoro-phenyl)-4-phenyl-pyrazol-3-yl]acetic acid Formula: C17H12ClFN2O2 MolecularWeight: 330.740783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=C2CC(=O)O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=C2CC(=O)O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H12ClFN2O2/c18-14-8-12(6-7-15(14)19)21-10-13(11-4-2-1-3-5-11)16(20-21)9-17(22)23/h1-8,10H,9H2,(H,22,23)