ethyl 2-(2-chloranyl-4-fluoranyl-5-isocyanato-phenyl)sulfanylethanoate

Systemtic Name: ethyl 2-(2-chloranyl-4-fluoranyl-5-isocyanato-phenyl)sulfanylethanoate Openeye Name: ethyl 2-(2-chloro-4-fluoro-5-isocyanato-phenyl)sulfanylacetate CAS Name: 2-[(2-chloro-4-fluoro-5-isocyanatophenyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-chloro-4-fluoro-5-isocyanatophenyl)sulfanylacetate Traditional Name: 2-[(2-chloro-4-fluoro-5-isocyanato-phenyl)thio]acetic acid ethyl ester Formula: C11H9ClFNO3S MolecularWeight: 289.710463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C(=C1)N=C=O)F)Cl

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C(=C1)N=C=O)F)Cl

InChI

InChI=1S/C11H9ClFNO3S/c1-2-17-11(16)5-18-10-4-9(14-6-15)8(13)3-7(10)12/h3-4H,2,5H2,1H3