5-[4-chloranyl-2-[(2-fluorophenyl)-oxidanyl-methyl]phenyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[4-chloranyl-2-[(2-fluorophenyl)-oxidanyl-methyl]phenyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[4-chloro-2-[(2-fluorophenyl)-hydroxy-methyl]phenyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[4-chloro-2-[(2-fluorophenyl)-hydroxymethyl]phenyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[4-chloro-2-[(2-fluorophenyl)-hydroxymethyl]phenyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[4-chloro-2-[(2-fluorophenyl)-hydroxy-methyl]phenyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C18H14ClFN2O3 MolecularWeight: 360.766763

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C2=C(C=C(C=C2)Cl)C(C3=CC=CC=C3F)O

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C2=C(C=C(C=C2)Cl)C(C3=CC=CC=C3F)O

InChI

InChI=1S/C18H14ClFN2O3/c1-22-16(14(9-21-22)18(24)25)11-7-6-10(19)8-13(11)17(23)12-4-2-3-5-15(12)20/h2-9,17,23H,1H3,(H,24,25)