2,5-bis[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(fluoranylmethyl)pentanenitrile

Systemtic Name: 2,5-bis[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(fluoranylmethyl)pentanenitrile Openeye Name: 2,5-bis(1,3-dioxoisoindolin-2-yl)-2-(fluoromethyl)pentanenitrile CAS Name: 2,5-bis(1,3-dioxo-2-isoindolyl)-2-(fluoromethyl)pentanenitrile IUPAC Name: 2,5-bis(1,3-dioxoisoindol-2-yl)-2-(fluoromethyl)pentanenitrile Traditional Name: 2-(fluoromethyl)-2,5-diphthalimido-valeronitrile Formula: C22H16FN3O4 MolecularWeight: 405.378543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(CF)(C#N)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(CF)(C#N)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H16FN3O4/c23-12-22(13-24,26-20(29)16-8-3-4-9-17(16)21(26)30)10-5-11-25-18(27)14-6-1-2-7-15(14)19(25)28/h1-4,6-9H,5,10-12H2