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

Systemtic Name: 3-[[2-(bromomethyl)-4-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 3-[[2-(bromomethyl)-4-methoxy-phenoxy]methyl]benzonitrile CAS Name: 3-[[2-(bromomethyl)-4-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 3-[[2-(bromomethyl)-4-methoxyphenoxy]methyl]benzonitrile Traditional Name: 3-[[2-(bromomethyl)-4-methoxy-phenoxy]methyl]benzonitrile Formula: C16H14BrNO2 MolecularWeight: 332.19186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C#N)CBr

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C#N)CBr

InChI

InChI=1S/C16H14BrNO2/c1-19-15-5-6-16(14(8-15)9-17)20-11-13-4-2-3-12(7-13)10-18/h2-8H,9,11H2,1H3