methyl 2-(3-bromanyl-5-fluoranyl-phenyl)-2-isocyano-ethanoate

Systemtic Name: methyl 2-(3-bromanyl-5-fluoranyl-phenyl)-2-isocyano-ethanoate Openeye Name: methyl 2-(3-bromo-5-fluoro-phenyl)-2-isocyano-acetate CAS Name: 2-(3-bromo-5-fluorophenyl)-2-isocyanoacetic acid methyl ester IUPAC Name: methyl 2-(3-bromo-5-fluorophenyl)-2-isocyanoacetate Traditional Name: 2-(3-bromo-5-fluoro-phenyl)-2-isocyano-acetic acid methyl ester Formula: C10H7BrFNO2 MolecularWeight: 272.070483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7BrFNO2/c1-13-9(10(14)15-2)6-3-7(11)5-8(12)4-6/h3-5,9H,2H3