methyl 4-fluoranyl-2-isocyano-benzoate

Systemtic Name: methyl 4-fluoranyl-2-isocyano-benzoate Openeye Name: methyl 4-fluoro-2-isocyano-benzoate CAS Name: 4-fluoro-2-isocyanobenzoic acid methyl ester IUPAC Name: methyl 4-fluoro-2-isocyanobenzoate Traditional Name: 4-fluoro-2-isocyano-benzoic acid methyl ester Formula: C9H6FNO2 MolecularWeight: 179.147843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)F)[N+]#[C-]

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)F)[N+]#[C-]

InChI

InChI=1S/C9H6FNO2/c1-11-8-5-6(10)3-4-7(8)9(12)13-2/h3-5H,2H3