2-(2-bromanyl-3,4-dimethoxy-phenyl)ethanenitrile

Systemtic Name: 2-(2-bromanyl-3,4-dimethoxy-phenyl)ethanenitrile Openeye Name: 2-(2-bromo-3,4-dimethoxy-phenyl)acetonitrile CAS Name: 2-(2-bromo-3,4-dimethoxyphenyl)acetonitrile IUPAC Name: 2-(2-bromo-3,4-dimethoxyphenyl)acetonitrile Traditional Name: 2-(2-bromo-3,4-dimethoxy-phenyl)acetonitrile Formula: C10H10BrNO2 MolecularWeight: 256.0959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10BrNO2/c1-13-8-4-3-7(5-6-12)9(11)10(8)14-2/h3-4H,5H2,1-2H3