2-(3-bromophenyl)-2-isocyano-ethanenitrile

Systemtic Name: 2-(3-bromophenyl)-2-isocyano-ethanenitrile Openeye Name: 2-(3-bromophenyl)-2-isocyano-acetonitrile CAS Name: 2-(3-bromophenyl)-2-isocyanoacetonitrile IUPAC Name: 2-(3-bromophenyl)-2-isocyanoacetonitrile Traditional Name: 2-(3-bromophenyl)-2-isocyano-acetonitrile Formula: C9H5BrN2 MolecularWeight: 221.0534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H5BrN2/c1-12-9(6-11)7-3-2-4-8(10)5-7/h2-5,9H