oxetan-2-one; 3,4,6-tris(fluoranyl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile

Systemtic Name: oxetan-2-one; 3,4,6-tris(fluoranyl)-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile Openeye Name: oxetan-2-one; 3,4,6-trifluoro-5-(4-methylphenoxy)phthalonitrile CAS Name: 2-oxetanone; 3,4,6-trifluoro-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile IUPAC Name: oxetan-2-one; 3,4,6-trifluoro-5-(4-methylphenoxy)benzene-1,2-dicarbonitrile Traditional Name: oxetan-2-one; 3,4,6-trifluoro-5-(4-methylphenoxy)phthalonitrile Formula: C18H11F3N2O3 MolecularWeight: 360.28675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C(=C(C(=C2F)F)C#N)C#N)F.C1COC1=O

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C(=C(C(=C2F)F)C#N)C#N)F.C1COC1=O

InChI

InChI=1S/C15H7F3N2O.C3H4O2/c1-8-2-4-9(5-3-8)21-15-13(17)11(7-20)10(6-19)12(16)14(15)18;4-3-1-2-5-3/h2-5H,1H3;1-2H2