2-(5-bromanyl-2,3-dimethoxy-phenyl)ethanenitrile

Systemtic Name: 2-(5-bromanyl-2,3-dimethoxy-phenyl)ethanenitrile Openeye Name: 2-(5-bromo-2,3-dimethoxy-phenyl)acetonitrile CAS Name: 2-(5-bromo-2,3-dimethoxyphenyl)acetonitrile IUPAC Name: 2-(5-bromo-2,3-dimethoxyphenyl)acetonitrile Traditional Name: 2-(5-bromo-2,3-dimethoxy-phenyl)acetonitrile Formula: C10H10BrNO2 MolecularWeight: 256.0959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)CC#N)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)CC#N)OC

InChI

InChI=1S/C10H10BrNO2/c1-13-9-6-8(11)5-7(3-4-12)10(9)14-2/h5-6H,3H2,1-2H3