2-bromanyl-2-(3-nitrophenyl)ethanenitrile

Systemtic Name: 2-bromanyl-2-(3-nitrophenyl)ethanenitrile Openeye Name: 2-bromo-2-(3-nitrophenyl)acetonitrile CAS Name: 2-bromo-2-(3-nitrophenyl)acetonitrile IUPAC Name: 2-bromo-2-(3-nitrophenyl)acetonitrile Traditional Name: 2-bromo-2-(3-nitrophenyl)acetonitrile Formula: C8H5BrN2O2 MolecularWeight: 241.0415

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(C#N)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(C#N)Br

InChI

InChI=1S/C8H5BrN2O2/c9-8(5-10)6-2-1-3-7(4-6)11(12)13/h1-4,8H