5-(2-bromanylethanoyl)-2,3-diethoxy-benzenecarbonitrile

Systemtic Name: 5-(2-bromanylethanoyl)-2,3-diethoxy-benzenecarbonitrile Openeye Name: 5-(2-bromoacetyl)-2,3-diethoxy-benzonitrile CAS Name: 5-(2-bromo-1-oxoethyl)-2,3-diethoxybenzonitrile IUPAC Name: 5-(2-bromoacetyl)-2,3-diethoxybenzonitrile Traditional Name: 5-(2-bromoacetyl)-2,3-diethoxy-benzonitrile Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)CBr)C#N)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)CBr)C#N)OCC

InChI

InChI=1S/C13H14BrNO3/c1-3-17-12-6-9(11(16)7-14)5-10(8-15)13(12)18-4-2/h5-6H,3-4,7H2,1-2H3