4-[2,2-bis(bromanyl)-2-fluoranyl-1-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 4-[2,2-bis(bromanyl)-2-fluoranyl-1-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 4-(2,2-dibromo-2-fluoro-1-hydroxy-ethyl)benzonitrile CAS Name: 4-(2,2-dibromo-2-fluoro-1-hydroxyethyl)benzonitrile IUPAC Name: 4-(2,2-dibromo-2-fluoro-1-hydroxyethyl)benzonitrile Traditional Name: 4-(2,2-dibromo-2-fluoro-1-hydroxy-ethyl)benzonitrile Formula: C9H6Br2FNO MolecularWeight: 322.956443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C(F)(Br)Br)O

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C(F)(Br)Br)O

InChI

InChI=1S/C9H6Br2FNO/c10-9(11,12)8(14)7-3-1-6(5-13)2-4-7/h1-4,8,14H