4-[(4-bromanyl-2,6-dimethoxy-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-bromanyl-2,6-dimethoxy-phenoxy)methyl]benzenecarbonitrile Openeye Name: 4-[(4-bromo-2,6-dimethoxy-phenoxy)methyl]benzonitrile CAS Name: 4-[(4-bromo-2,6-dimethoxyphenoxy)methyl]benzonitrile IUPAC Name: 4-[(4-bromo-2,6-dimethoxyphenoxy)methyl]benzonitrile Traditional Name: 4-[(4-bromo-2,6-dimethoxy-phenoxy)methyl]benzonitrile Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)OC)Br

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)OC)Br

InChI

InChI=1S/C16H14BrNO3/c1-19-14-7-13(17)8-15(20-2)16(14)21-10-12-5-3-11(9-18)4-6-12/h3-8H,10H2,1-2H3