methyl 2-(2-chloranyl-4-fluoranyl-5-nitro-phenyl)sulfanylethanoate

Systemtic Name: methyl 2-(2-chloranyl-4-fluoranyl-5-nitro-phenyl)sulfanylethanoate Openeye Name: methyl 2-(2-chloro-4-fluoro-5-nitro-phenyl)sulfanylacetate CAS Name: 2-[(2-chloro-4-fluoro-5-nitrophenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-chloro-4-fluoro-5-nitrophenyl)sulfanylacetate Traditional Name: 2-[(2-chloro-4-fluoro-5-nitro-phenyl)thio]acetic acid methyl ester Formula: C9H7ClFNO4S MolecularWeight: 279.672583

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C(C(=C1)[N+](=O)[O-])F)Cl

Isomeric SMILES

COC(=O)CSC1=C(C=C(C(=C1)[N+](=O)[O-])F)Cl

InChI

InChI=1S/C9H7ClFNO4S/c1-16-9(13)4-17-8-3-7(12(14)15)6(11)2-5(8)10/h2-3H,4H2,1H3