2-(4-bromanyl-2-methyl-phenoxy)ethanenitrile

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)ethanenitrile Openeye Name: 2-(4-bromo-2-methyl-phenoxy)acetonitrile CAS Name: 2-(4-bromo-2-methylphenoxy)acetonitrile IUPAC Name: 2-(4-bromo-2-methylphenoxy)acetonitrile Traditional Name: 2-(4-bromo-2-methyl-phenoxy)acetonitrile Formula: C9H8BrNO MolecularWeight: 226.06992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC#N

InChI

InChI=1S/C9H8BrNO/c1-7-6-8(10)2-3-9(7)12-5-4-11/h2-3,6H,5H2,1H3