3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylpropyl)pyrazole-4-carboxylic acid

Systemtic Name: 3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylpropyl)pyrazole-4-carboxylic acid Openeye Name: 3-(3-fluoro-4-methoxy-phenyl)-1-isobutyl-pyrazole-4-carboxylic acid CAS Name: 3-(3-fluoro-4-methoxyphenyl)-1-(2-methylpropyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-(3-fluoro-4-methoxyphenyl)-1-(2-methylpropyl)pyrazole-4-carboxylic acid Traditional Name: 3-(3-fluoro-4-methoxy-phenyl)-1-isobutyl-pyrazole-4-carboxylic acid Formula: C15H17FN2O3 MolecularWeight: 292.305483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=N1)C2=CC(=C(C=C2)OC)F)C(=O)O

Isomeric SMILES

CC(C)CN1C=C(C(=N1)C2=CC(=C(C=C2)OC)F)C(=O)O

InChI

InChI=1S/C15H17FN2O3/c1-9(2)7-18-8-11(15(19)20)14(17-18)10-4-5-13(21-3)12(16)6-10/h4-6,8-9H,7H2,1-3H3,(H,19,20)