methyl 3-bromanyl-5-cyano-benzoate

Systemtic Name: methyl 3-bromanyl-5-cyano-benzoate Openeye Name: methyl 3-bromo-5-cyano-benzoate CAS Name: 3-bromo-5-cyanobenzoic acid methyl ester IUPAC Name: methyl 3-bromo-5-cyanobenzoate Traditional Name: 3-bromo-5-cyano-benzoic acid methyl ester Formula: C9H6BrNO2 MolecularWeight: 240.05344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6BrNO2/c1-13-9(12)7-2-6(5-11)3-8(10)4-7/h2-4H,1H3