5-[[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1-phenylethyl)pentyl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 5-[[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1-phenylethyl)pentyl]amino]-3H-2-benzofuran-1-one Openeye Name: 5-[[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(1-phenylethyl)pentyl]amino]-3H-isobenzofuran-1-one CAS Name: 5-[[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1-phenylethyl)pentyl]amino]-3H-isobenzofuran-1-one IUPAC Name: 5-[[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1-phenylethyl)pentyl]amino]-3H-2-benzofuran-1-one Traditional Name: 5-[[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(1-phenylethyl)pentyl]amino]phthalide Formula: C29H32FNO4 MolecularWeight: 477.567083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(CC(C)(C)C2=C(C=CC(=C2)F)OC)(CNC3=CC4=C(C=C3)C(=O)OC4)O

Isomeric SMILES

CC(C1=CC=CC=C1)C(CC(C)(C)C2=C(C=CC(=C2)F)OC)(CNC3=CC4=C(C=C3)C(=O)OC4)O

InChI

InChI=1S/C29H32FNO4/c1-19(20-8-6-5-7-9-20)29(33,17-28(2,3)25-15-22(30)10-13-26(25)34-4)18-31-23-11-12-24-21(14-23)16-35-27(24)32/h5-15,19,31,33H,16-18H2,1-4H3