S-ethyl 2-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]ethanethioate

Systemtic Name: S-ethyl 2-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]ethanethioate Openeye Name: S-ethyl 2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]ethanethioate CAS Name: 2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]ethanethioic acid S-ethyl ester IUPAC Name: S-ethyl 2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]ethanethioate Traditional Name: 2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]ethanethioic acid S-ethyl ester Formula: C11H9ClF3NO3S MolecularWeight: 327.70727

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC1=C(C=C(C(=C1)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCSC(=O)CC1=C(C=C(C(=C1)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H9ClF3NO3S/c1-2-20-10(17)4-6-3-8(12)7(11(13,14)15)5-9(6)16(18)19/h3,5H,2,4H2,1H3