methyl 3-(4-cyano-2-fluoranyl-phenyl)sulfanylpropanoate

Systemtic Name: methyl 3-(4-cyano-2-fluoranyl-phenyl)sulfanylpropanoate Openeye Name: methyl 3-(4-cyano-2-fluoro-phenyl)sulfanylpropanoate CAS Name: 3-[(4-cyano-2-fluorophenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4-cyano-2-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-cyano-2-fluoro-phenyl)thio]propionic acid methyl ester Formula: C11H10FNO2S MolecularWeight: 239.266003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

COC(=O)CCSC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C11H10FNO2S/c1-15-11(14)4-5-16-10-3-2-8(7-13)6-9(10)12/h2-3,6H,4-5H2,1H3