3-[[3-[(5-cyano-2-oxidanyl-phenyl)methyl]-5-fluoranyl-2-oxidanyl-phenyl]methyl]-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-[[3-[(5-cyano-2-oxidanyl-phenyl)methyl]-5-fluoranyl-2-oxidanyl-phenyl]methyl]-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-[[3-[(5-cyano-2-hydroxy-phenyl)methyl]-5-fluoro-2-hydroxy-phenyl]methyl]-4-hydroxy-benzonitrile CAS Name: 3-[[3-[(5-cyano-2-hydroxyphenyl)methyl]-5-fluoro-2-hydroxyphenyl]methyl]-4-hydroxybenzonitrile IUPAC Name: 3-[[3-[(5-cyano-2-hydroxyphenyl)methyl]-5-fluoro-2-hydroxyphenyl]methyl]-4-hydroxybenzonitrile Traditional Name: 3-[3-(5-cyano-2-hydroxy-benzyl)-5-fluoro-2-hydroxy-benzyl]-4-hydroxy-benzonitrile Formula: C22H15FN2O3 MolecularWeight: 374.364503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C#N)O)F)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C#N)O)F)O

InChI

InChI=1S/C22H15FN2O3/c23-19-9-17(7-15-5-13(11-24)1-3-20(15)26)22(28)18(10-19)8-16-6-14(12-25)2-4-21(16)27/h1-6,9-10,26-28H,7-8H2