2-(4-fluoranyl-3-methyl-phenyl)-3-[(E)-2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethenyl]-4-propan-2-yl-isoquinolin-1-one

Systemtic Name: 2-(4-fluoranyl-3-methyl-phenyl)-3-[(E)-2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethenyl]-4-propan-2-yl-isoquinolin-1-one Openeye Name: 2-(4-fluoro-3-methyl-phenyl)-3-[(E)-2-(4-hydroxy-6-oxo-tetrahydropyran-2-yl)vinyl]-4-isopropyl-isoquinolin-1-one CAS Name: 2-(4-fluoro-3-methylphenyl)-3-[(E)-2-(4-hydroxy-6-oxo-2-oxanyl)ethenyl]-4-propan-2-yl-1-isoquinolinone IUPAC Name: 2-(4-fluoro-3-methylphenyl)-3-[(E)-2-(4-hydroxy-6-oxooxan-2-yl)ethenyl]-4-propan-2-ylisoquinolin-1-one Traditional Name: 2-(4-fluoro-3-methyl-phenyl)-3-[(E)-2-(4-hydroxy-6-keto-tetrahydropyran-2-yl)vinyl]-4-isopropyl-isocarbostyril Formula: C26H26FNO4 MolecularWeight: 435.487343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=C(C3=CC=CC=C3C2=O)C(C)C)C=CC4CC(CC(=O)O4)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=C(C3=CC=CC=C3C2=O)C(C)C)/C=C/C4CC(CC(=O)O4)O)F

InChI

InChI=1S/C26H26FNO4/c1-15(2)25-20-6-4-5-7-21(20)26(31)28(17-8-10-22(27)16(3)12-17)23(25)11-9-19-13-18(29)14-24(30)32-19/h4-12,15,18-19,29H,13-14H2,1-3H3/b11-9+