1-[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-2H-indazol-3-one

Systemtic Name: 1-[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-2H-indazol-3-one Openeye Name: 1-[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-2H-indazol-3-one CAS Name: 1-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-2H-indazol-3-one IUPAC Name: 1-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-2H-indazol-3-one Traditional Name: 1-[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]indazolin-3-one Formula: C21H22F4N2O3 MolecularWeight: 426.404593

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CN1C2=CC=CC=C2C(=O)N1)(C(F)(F)F)O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(C)(CC(CN1C2=CC=CC=C2C(=O)N1)(C(F)(F)F)O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C21H22F4N2O3/c1-19(2,15-10-13(22)8-9-17(15)30-3)11-20(29,21(23,24)25)12-27-16-7-5-4-6-14(16)18(28)26-27/h4-10,29H,11-12H2,1-3H3,(H,26,28)