O-butan-2-yl 2-chloranyl-2-fluoranyl-2-nitro-ethanethioate

Systemtic Name: O-butan-2-yl 2-chloranyl-2-fluoranyl-2-nitro-ethanethioate Openeye Name: O-sec-butyl 2-chloro-2-fluoro-2-nitro-ethanethioate CAS Name: 2-chloro-2-fluoro-2-nitroethanethioic acid O-butan-2-yl ester IUPAC Name: O-butan-2-yl 2-chloro-2-fluoro-2-nitroethanethioate Traditional Name: 2-chloro-2-fluoro-2-nitro-ethanethioic acid O-sec-butyl ester Formula: C6H9ClFNO3S MolecularWeight: 229.656963

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=S)C([N+](=O)[O-])(F)Cl

Isomeric SMILES

CCC(C)OC(=S)C([N+](=O)[O-])(F)Cl

InChI

InChI=1S/C6H9ClFNO3S/c1-3-4(2)12-5(13)6(7,8)9(10)11/h4H,3H2,1-2H3