1-tert-butyl-3-(3-fluoranyl-4-methoxy-phenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-tert-butyl-3-(3-fluoranyl-4-methoxy-phenyl)pyrazole-4-carboxylic acid Openeye Name: 1-tert-butyl-3-(3-fluoro-4-methoxy-phenyl)pyrazole-4-carboxylic acid CAS Name: 1-tert-butyl-3-(3-fluoro-4-methoxyphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-tert-butyl-3-(3-fluoro-4-methoxyphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-tert-butyl-3-(3-fluoro-4-methoxy-phenyl)pyrazole-4-carboxylic acid Formula: C15H17FN2O3 MolecularWeight: 292.305483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC(=C(C=C2)OC)F)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC(=C(C=C2)OC)F)C(=O)O

InChI

InChI=1S/C15H17FN2O3/c1-15(2,3)18-8-10(14(19)20)13(17-18)9-5-6-12(21-4)11(16)7-9/h5-8H,1-4H3,(H,19,20)