1,1-bis(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 1,1-bis(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile Openeye Name: 1,1-bis(4-fluorophenyl)-3H-isobenzofuran-5-carbonitrile CAS Name: 1,1-bis(4-fluorophenyl)-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1,1-bis(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile Traditional Name: 1,1-bis(4-fluorophenyl)phthalan-5-carbonitrile Formula: C21H13F2NO MolecularWeight: 333.330826

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C#N)C(O1)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1C2=C(C=CC(=C2)C#N)C(O1)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H13F2NO/c22-18-6-2-16(3-7-18)21(17-4-8-19(23)9-5-17)20-10-1-14(12-24)11-15(20)13-25-21/h1-11H,13H2