methyl 5-fluoranyl-2-isocyanatosulfonyl-benzoate

Systemtic Name: methyl 5-fluoranyl-2-isocyanatosulfonyl-benzoate Openeye Name: methyl 5-fluoro-2-isocyanatosulfonyl-benzoate CAS Name: 5-fluoro-2-isocyanatosulfonylbenzoic acid methyl ester IUPAC Name: methyl 5-fluoro-2-isocyanatosulfonylbenzoate Traditional Name: 5-fluoro-2-isocyanatosulfonyl-benzoic acid methyl ester Formula: C9H6FNO5S MolecularWeight: 259.211043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6FNO5S/c1-16-9(13)7-4-6(10)2-3-8(7)17(14,15)11-5-12/h2-4H,1H3