5-[[4-(4-fluorophenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 5-[[4-(4-fluorophenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]amino]-3H-2-benzofuran-1-one Openeye Name: 5-[[4-(4-fluorophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-3H-isobenzofuran-1-one CAS Name: 5-[[4-(4-fluorophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-3H-isobenzofuran-1-one IUPAC Name: 5-[[4-(4-fluorophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-3H-2-benzofuran-1-one Traditional Name: 5-[[4-(4-fluorophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]phthalide Formula: C21H21F4NO3 MolecularWeight: 411.389953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CNC1=CC2=C(C=C1)C(=O)OC2)(C(F)(F)F)O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(CC(CNC1=CC2=C(C=C1)C(=O)OC2)(C(F)(F)F)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21F4NO3/c1-19(2,14-3-5-15(22)6-4-14)11-20(28,21(23,24)25)12-26-16-7-8-17-13(9-16)10-29-18(17)27/h3-9,26,28H,10-12H2,1-2H3