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

Systemtic Name: 2-(3,4-dimethoxy-2-oxidanyl-phenyl)ethanenitrile Openeye Name: 2-(2-hydroxy-3,4-dimethoxy-phenyl)acetonitrile CAS Name: 2-(2-hydroxy-3,4-dimethoxyphenyl)acetonitrile IUPAC Name: 2-(2-hydroxy-3,4-dimethoxyphenyl)acetonitrile Traditional Name: 2-(2-hydroxy-3,4-dimethoxy-phenyl)acetonitrile Formula: C10H11NO3 MolecularWeight: 193.19924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO3/c1-13-8-4-3-7(5-6-11)9(12)10(8)14-2/h3-4,12H,5H2,1-2H3