methyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)ethanoate

Systemtic Name: methyl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)ethanoate Openeye Name: methyl 2-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)acetate CAS Name: 2-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)acetic acid methyl ester IUPAC Name: methyl 2-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)acetate Traditional Name: 2-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)acetic acid methyl ester Formula: C10H7ClFNO3S MolecularWeight: 275.683883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=C(C=C(C(=C1)N=C=S)F)Cl

Isomeric SMILES

COC(=O)COC1=C(C=C(C(=C1)N=C=S)F)Cl

InChI

InChI=1S/C10H7ClFNO3S/c1-15-10(14)4-16-9-3-8(13-5-17)7(12)2-6(9)11/h2-3H,4H2,1H3