2-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)ethanenitrile

Systemtic Name: 2-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)ethanenitrile Openeye Name: 2-(2-bromo-5-hydroxy-4-methoxy-phenyl)acetonitrile CAS Name: 2-(2-bromo-5-hydroxy-4-methoxyphenyl)acetonitrile IUPAC Name: 2-(2-bromo-5-hydroxy-4-methoxyphenyl)acetonitrile Traditional Name: 2-(2-bromo-5-hydroxy-4-methoxy-phenyl)acetonitrile Formula: C9H8BrNO2 MolecularWeight: 242.06932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8BrNO2/c1-13-9-5-7(10)6(2-3-11)4-8(9)12/h4-5,12H,2H2,1H3