6-chloranyl-3-[2-(1-ethylsulfanylethyl)-6-fluoranyl-phenoxy]-1-oxidanidyl-pyridazin-1-ium

Systemtic Name: 6-chloranyl-3-[2-(1-ethylsulfanylethyl)-6-fluoranyl-phenoxy]-1-oxidanidyl-pyridazin-1-ium Openeye Name: 6-chloro-3-[2-(1-ethylsulfanylethyl)-6-fluoro-phenoxy]-1-oxido-pyridazin-1-ium CAS Name: 6-chloro-3-[2-[1-(ethylthio)ethyl]-6-fluorophenoxy]-1-oxidopyridazin-1-ium IUPAC Name: 6-chloro-3-[2-(1-ethylsulfanylethyl)-6-fluorophenoxy]-1-oxidopyridazin-1-ium Traditional Name: 6-chloro-3-[2-[1-(ethylthio)ethyl]-6-fluoro-phenoxy]-1-oxido-pyridazin-1-ium Formula: C14H14ClFN2O2S MolecularWeight: 328.789563

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)C1=C(C(=CC=C1)F)OC2=N[N+](=C(C=C2)Cl)[O-]

Isomeric SMILES

CCSC(C)C1=C(C(=CC=C1)F)OC2=N[N+](=C(C=C2)Cl)[O-]

InChI

InChI=1S/C14H14ClFN2O2S/c1-3-21-9(2)10-5-4-6-11(16)14(10)20-13-8-7-12(15)18(19)17-13/h4-9H,3H2,1-2H3