2-(3-bromanyl-5-methoxy-phenyl)ethanenitrile

Systemtic Name: 2-(3-bromanyl-5-methoxy-phenyl)ethanenitrile Openeye Name: 2-(3-bromo-5-methoxy-phenyl)acetonitrile CAS Name: 2-(3-bromo-5-methoxyphenyl)acetonitrile IUPAC Name: 2-(3-bromo-5-methoxyphenyl)acetonitrile Traditional Name: 2-(3-bromo-5-methoxy-phenyl)acetonitrile Formula: C9H8BrNO MolecularWeight: 226.06992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8BrNO/c1-12-9-5-7(2-3-11)4-8(10)6-9/h4-6H,2H2,1H3