1-(3-chloranyl-4-methyl-phenyl)-5-(4-fluoranyl-3-methyl-phenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-(4-fluoranyl-3-methyl-phenyl)pyrazole-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-(4-fluoro-3-methyl-phenyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-chloro-4-methylphenyl)-5-(4-fluoro-3-methylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-(4-fluoro-3-methylphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-(4-fluoro-3-methyl-phenyl)pyrazole-3-carboxylic acid Formula: C18H14ClFN2O2 MolecularWeight: 344.767363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC(=C(C=C3)F)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC(=C(C=C3)F)C)Cl

InChI

InChI=1S/C18H14ClFN2O2/c1-10-3-5-13(8-14(10)19)22-17(9-16(21-22)18(23)24)12-4-6-15(20)11(2)7-12/h3-9H,1-2H3,(H,23,24)