2-[4-(5-chloranyl-3-fluoranyl-pyridin-2-yl)oxy-3-(2-methoxy-2-oxidanylidene-ethyl)phenoxy]propanethioate

Systemtic Name: 2-[4-(5-chloranyl-3-fluoranyl-pyridin-2-yl)oxy-3-(2-methoxy-2-oxidanylidene-ethyl)phenoxy]propanethioate Openeye Name: 2-[4-[(5-chloro-3-fluoro-2-pyridyl)oxy]-3-(2-methoxy-2-oxo-ethyl)phenoxy]propanethioate CAS Name: 2-[4-[(5-chloro-3-fluoro-2-pyridinyl)oxy]-3-(2-methoxy-2-oxoethyl)phenoxy]propanethioate IUPAC Name: 2-[4-(5-chloro-3-fluoropyridin-2-yl)oxy-3-(2-methoxy-2-oxoethyl)phenoxy]propanethioate Traditional Name: 2-[4-[(5-chloro-3-fluoro-2-pyridyl)oxy]-3-(2-keto-2-methoxy-ethyl)phenoxy]thiopropionate Formula: C17H14ClFNO5S- MolecularWeight: 398.813163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=S)[O-])OC1=CC(=C(C=C1)OC2=NC=C(C=C2F)Cl)CC(=O)OC

Isomeric SMILES

CC(C(=S)[O-])OC1=CC(=C(C=C1)OC2=NC=C(C=C2F)Cl)CC(=O)OC

InChI

InChI=1S/C17H15ClFNO5S/c1-9(17(22)26)24-12-3-4-14(10(5-12)6-15(21)23-2)25-16-13(19)7-11(18)8-20-16/h3-5,7-9H,6H2,1-2H3,(H,22,26)/p-1