4-[[4-bromanyl-2-(hydroxymethyl)phenoxy]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[4-bromanyl-2-(hydroxymethyl)phenoxy]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[4-bromo-2-(hydroxymethyl)phenoxy]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[4-bromo-2-(hydroxymethyl)phenoxy]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[4-bromo-2-(hydroxymethyl)phenoxy]methyl]-3-fluorobenzonitrile Traditional Name: 4-[(4-bromo-2-methylol-phenoxy)methyl]-3-fluoro-benzonitrile Formula: C15H11BrFNO2 MolecularWeight: 336.155743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)COC2=C(C=C(C=C2)Br)CO

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)COC2=C(C=C(C=C2)Br)CO

InChI

InChI=1S/C15H11BrFNO2/c16-13-3-4-15(12(6-13)8-19)20-9-11-2-1-10(7-18)5-14(11)17/h1-6,19H,8-9H2