propan-2-yl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)ethanoate

Systemtic Name: propan-2-yl 2-(2-chloranyl-4-fluoranyl-5-isothiocyanato-phenoxy)ethanoate Openeye Name: isopropyl 2-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)acetate CAS Name: 2-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(2-chloro-4-fluoro-5-isothiocyanatophenoxy)acetate Traditional Name: 2-(2-chloro-4-fluoro-5-isothiocyanato-phenoxy)acetic acid isopropyl ester Formula: C12H11ClFNO3S MolecularWeight: 303.737043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClFNO3S/c1-7(2)18-12(16)5-17-11-4-10(15-6-19)9(14)3-8(11)13/h3-4,7H,5H2,1-2H3