2-chloranyl-5-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]benzoic acid Openeye Name: 2-chloro-5-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]benzoic acid CAS Name: 2-chloro-5-[4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-1-pyrazolyl]benzoic acid IUPAC Name: 2-chloro-5-[4-(5-fluoro-2-hydroxybenzoyl)pyrazol-1-yl]benzoic acid Traditional Name: 2-chloro-5-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]benzoic acid Formula: C17H10ClFN2O4 MolecularWeight: 360.723703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)F)O)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)F)O)C(=O)O)Cl

InChI

InChI=1S/C17H10ClFN2O4/c18-14-3-2-11(6-12(14)17(24)25)21-8-9(7-20-21)16(23)13-5-10(19)1-4-15(13)22/h1-8,22H,(H,24,25)