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

Systemtic Name: 4-[[4-(hydroxymethyl)-2,6-dimethyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(hydroxymethyl)-2,6-dimethyl-phenoxy]methyl]benzonitrile CAS Name: 4-[[4-(hydroxymethyl)-2,6-dimethylphenoxy]methyl]benzonitrile IUPAC Name: 4-[[4-(hydroxymethyl)-2,6-dimethylphenoxy]methyl]benzonitrile Traditional Name: 4-[(2,6-dimethyl-4-methylol-phenoxy)methyl]benzonitrile Formula: C17H17NO2 MolecularWeight: 267.32238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO2/c1-12-7-16(10-19)8-13(2)17(12)20-11-15-5-3-14(9-18)4-6-15/h3-8,19H,10-11H2,1-2H3