3-(2-azanyl-2-bromanyl-ethanoyl)-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-(2-azanyl-2-bromanyl-ethanoyl)-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-(2-amino-2-bromo-acetyl)-5-fluoro-benzonitrile CAS Name: 3-(2-amino-2-bromo-1-oxoethyl)-5-fluorobenzonitrile IUPAC Name: 3-(2-amino-2-bromoacetyl)-5-fluorobenzonitrile Traditional Name: 3-(2-amino-2-bromo-acetyl)-5-fluoro-benzonitrile Formula: C9H6BrFN2O MolecularWeight: 257.059143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6BrFN2O/c10-9(13)8(14)6-1-5(4-12)2-7(11)3-6/h1-3,9H,13H2