5-(2-bromanylethanoyl)furan-3-carbonitrile; 5-ethanoylfuran-3-carbonitrile

Systemtic Name: 5-(2-bromanylethanoyl)furan-3-carbonitrile; 5-ethanoylfuran-3-carbonitrile Openeye Name: 5-acetylfuran-3-carbonitrile; 5-(2-bromoacetyl)furan-3-carbonitrile CAS Name: 5-acetyl-3-furancarbonitrile; 5-(2-bromo-1-oxoethyl)-3-furancarbonitrile IUPAC Name: 5-acetylfuran-3-carbonitrile; 5-(2-bromoacetyl)furan-3-carbonitrile Traditional Name: 5-acetyl-3-furonitrile; 5-(2-bromoacetyl)-3-furonitrile Formula: C14H9BrN2O4 MolecularWeight: 349.13626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CO1)C#N.C1=C(OC=C1C#N)C(=O)CBr

Isomeric SMILES

CC(=O)C1=CC(=CO1)C#N.C1=C(OC=C1C#N)C(=O)CBr

InChI

InChI=1S/C7H4BrNO2.C7H5NO2/c8-2-6(10)7-1-5(3-9)4-11-7;1-5(9)7-2-6(3-8)4-10-7/h1,4H,2H2;2,4H,1H3