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

Systemtic Name: 5-[[2-oxidanyl-4-phenyl-2-(trifluoromethyl)pentyl]amino]-3H-2-benzofuran-1-one Openeye Name: 5-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-3H-isobenzofuran-1-one CAS Name: 5-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-3H-isobenzofuran-1-one IUPAC Name: 5-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-3H-2-benzofuran-1-one Traditional Name: 5-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]phthalide Formula: C20H20F3NO3 MolecularWeight: 379.37291

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20F3NO3/c1-13(14-5-3-2-4-6-14)10-19(26,20(21,22)23)12-24-16-7-8-17-15(9-16)11-27-18(17)25/h2-9,13,24,26H,10-12H2,1H3