methyl 4-cyano-3-fluoranyl-benzoate

Systemtic Name: methyl 4-cyano-3-fluoranyl-benzoate Openeye Name: methyl 4-cyano-3-fluoro-benzoate CAS Name: 4-cyano-3-fluorobenzoic acid methyl ester IUPAC Name: methyl 4-cyano-3-fluorobenzoate Traditional Name: 4-cyano-3-fluoro-benzoic acid methyl ester Formula: C9H6FNO2 MolecularWeight: 179.147843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6FNO2/c1-13-9(12)6-2-3-7(5-11)8(10)4-6/h2-4H,1H3