7-cyclohexyl-6-(3-fluoranyl-4-methoxy-phenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

Systemtic Name: 7-cyclohexyl-6-(3-fluoranyl-4-methoxy-phenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Openeye Name: 7-cyclohexyl-6-(3-fluoro-4-methoxy-phenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid CAS Name: 7-cyclohexyl-6-(3-fluoro-4-methoxyphenyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-cyclohexyl-6-(3-fluoro-4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Traditional Name: 7-cyclohexyl-6-(3-fluoro-4-methoxy-phenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Formula: C20H20FN3O3 MolecularWeight: 369.389503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4)F

InChI

InChI=1S/C20H20FN3O3/c1-27-17-8-7-13(9-16(17)21)14-10-22-19-15(20(25)26)11-23-24(19)18(14)12-5-3-2-4-6-12/h7-12H,2-6H2,1H3,(H,25,26)