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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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