2-(3-bromanyl-2-methyl-phenyl)ethanenitrile

Systemtic Name: 2-(3-bromanyl-2-methyl-phenyl)ethanenitrile Openeye Name: 2-(3-bromo-2-methyl-phenyl)acetonitrile CAS Name: 2-(3-bromo-2-methylphenyl)acetonitrile IUPAC Name: 2-(3-bromo-2-methylphenyl)acetonitrile Traditional Name: 2-(3-bromo-2-methyl-phenyl)acetonitrile Formula: C9H8BrN MolecularWeight: 210.07052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Br)CC#N

Isomeric SMILES

CC1=C(C=CC=C1Br)CC#N

InChI

InChI=1S/C9H8BrN/c1-7-8(5-6-11)3-2-4-9(7)10/h2-4H,5H2,1H3