3-fluoranyl-5-[2-[(4R)-4-[(5-methoxy-3-oxidanylidene-1H-isoindol-2-yl)methyl]-2,5-bis(oxidanylidene)imidazolidin-4-yl]ethynyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-5-[2-[(4R)-4-[(5-methoxy-3-oxidanylidene-1H-isoindol-2-yl)methyl]-2,5-bis(oxidanylidene)imidazolidin-4-yl]ethynyl]benzenecarbonitrile Openeye Name: 3-fluoro-5-[2-[(4R)-4-[(6-methoxy-1-oxo-isoindolin-2-yl)methyl]-2,5-dioxo-imidazolidin-4-yl]ethynyl]benzonitrile CAS Name: 3-fluoro-5-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxo-4-imidazolidinyl]ethynyl]benzonitrile IUPAC Name: 3-fluoro-5-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]benzonitrile Traditional Name: 3-[2-[(4R)-2,5-diketo-4-[(1-keto-6-methoxy-isoindolin-2-yl)methyl]imidazolidin-4-yl]ethynyl]-5-fluoro-benzonitrile Formula: C22H15FN4O4 MolecularWeight: 418.377303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(C2=O)CC3(C(=O)NC(=O)N3)C#CC4=CC(=CC(=C4)F)C#N)C=C1

Isomeric SMILES

COC1=CC2=C(CN(C2=O)C[C@@]3(C(=O)NC(=O)N3)C#CC4=CC(=CC(=C4)F)C#N)C=C1

InChI

InChI=1S/C22H15FN4O4/c1-31-17-3-2-15-11-27(19(28)18(15)9-17)12-22(20(29)25-21(30)26-22)5-4-13-6-14(10-24)8-16(23)7-13/h2-3,6-9H,11-12H2,1H3,(H2,25,26,29,30)/t22-/m1/s1