N-methoxy-3-(trifluoromethylsulfanyl)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-imine

Systemtic Name: N-methoxy-3-(trifluoromethylsulfanyl)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-imine Openeye Name: N-methoxy-3-(trifluoromethylsulfanyl)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-imine CAS Name: N-methoxy-3-(trifluoromethylthio)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-imine IUPAC Name: N-methoxy-3-(trifluoromethylsulfanyl)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-imine Traditional Name: (E)-methoxy-[3-(trifluoromethylthio)-1-aza-5-azoniabicyclo[3.1.0]hexa-3,5-dien-2-ylidene]amine Formula: C6H5F3N3OS+ MolecularWeight: 224.18361

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Descriptors Computed from Structure

Canonical SMILES:

CON=C1C(=C[N+]2=CN12)SC(F)(F)F

Isomeric SMILES

CO/N=C/1\C(=C[N+]2=CN12)SC(F)(F)F

InChI

InChI=1S/C6H5F3N3OS/c1-13-10-5-4(14-6(7,8)9)2-11-3-12(5)11/h2-3H,1H3/q+1/b10-5+