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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(fluoranylmethyl)-5-phenylmethoxy-pentanenitrile Openeye Name: 5-benzyloxy-2-(1,3-dioxoisoindolin-2-yl)-2-(fluoromethyl)pentanenitrile CAS Name: 2-(1,3-dioxo-2-isoindolyl)-2-(fluoromethyl)-5-phenylmethoxypentanenitrile IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-2-(fluoromethyl)-5-phenylmethoxypentanenitrile Traditional Name: 5-benzoxy-2-(fluoromethyl)-2-phthalimido-valeronitrile Formula: C21H19FN2O3 MolecularWeight: 366.385563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCC(CF)(C#N)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)COCCCC(CF)(C#N)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H19FN2O3/c22-14-21(15-23,11-6-12-27-13-16-7-2-1-3-8-16)24-19(25)17-9-4-5-10-18(17)20(24)26/h1-5,7-10H,6,11-14H2