1-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)propan-2-one

Systemtic Name: 1-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)propan-2-one Openeye Name: 1-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)propan-2-one CAS Name: 1-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)-2-propanone IUPAC Name: 1-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)propan-2-one Traditional Name: 1-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)acetone Formula: C10H7ClFNO2S MolecularWeight: 259.684483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7ClFNO2S/c1-6(14)4-15-10-3-9(13-5-16)8(12)2-7(10)11/h2-3H,4H2,1H3