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

Systemtic Name: 4-fluoranyl-3-[[2-(hydroxymethyl)-4-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[2-(hydroxymethyl)-4-methoxy-phenoxy]methyl]benzonitrile CAS Name: 4-fluoro-3-[[2-(hydroxymethyl)-4-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[2-(hydroxymethyl)-4-methoxyphenoxy]methyl]benzonitrile Traditional Name: 4-fluoro-3-[(4-methoxy-2-methylol-phenoxy)methyl]benzonitrile Formula: C16H14FNO3 MolecularWeight: 287.285663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=C(C=CC(=C2)C#N)F)CO

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=C(C=CC(=C2)C#N)F)CO

InChI

InChI=1S/C16H14FNO3/c1-20-14-3-5-16(12(7-14)9-19)21-10-13-6-11(8-18)2-4-15(13)17/h2-7,19H,9-10H2,1H3