4-[[4-(bromomethyl)-2,6-dimethyl-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(bromomethyl)-2,6-dimethyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(bromomethyl)-2,6-dimethyl-phenoxy]methyl]benzonitrile CAS Name: 4-[[4-(bromomethyl)-2,6-dimethylphenoxy]methyl]benzonitrile IUPAC Name: 4-[[4-(bromomethyl)-2,6-dimethylphenoxy]methyl]benzonitrile Traditional Name: 4-[[4-(bromomethyl)-2,6-dimethyl-phenoxy]methyl]benzonitrile Formula: C17H16BrNO MolecularWeight: 330.21904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)C)CBr

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)C)CBr

InChI

InChI=1S/C17H16BrNO/c1-12-7-16(9-18)8-13(2)17(12)20-11-15-5-3-14(10-19)4-6-15/h3-8H,9,11H2,1-2H3