4-[2,2-bis(bromanyl)ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[2,2-bis(bromanyl)ethanoyl]benzenecarbonitrile Openeye Name: 4-(2,2-dibromoacetyl)benzonitrile CAS Name: 4-(2,2-dibromo-1-oxoethyl)benzonitrile IUPAC Name: 4-(2,2-dibromoacetyl)benzonitrile Traditional Name: 4-(2,2-dibromoacetyl)benzonitrile Formula: C9H5Br2NO MolecularWeight: 314.905352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)C(Br)Br

Isomeric SMILES

[14CH]1=[14CH][14C](=[14CH][14CH]=[14C]1C#N)C(=O)C(Br)Br

InChI

InChI=1S/C9H5Br2NO/c10-9(11)8(13)7-3-1-6(5-12)2-4-7/h1-4,9H/i1+2,2+2,3+2,4+2,6+2,7+2