[bis(methylsulfanyl)-[2-(trifluoromethyl)phenyl]azaniumyl]methanoate

Systemtic Name: [bis(methylsulfanyl)-[2-(trifluoromethyl)phenyl]azaniumyl]methanoate Openeye Name: [bis(methylsulfanyl)-[2-(trifluoromethyl)phenyl]ammonio]formate CAS Name: [bis(methylthio)-[2-(trifluoromethyl)phenyl]ammonio]formate IUPAC Name: [bis(methylsulfanyl)-[2-(trifluoromethyl)phenyl]azaniumyl]formate Traditional Name: [bis(methylthio)-[2-(trifluoromethyl)phenyl]ammonio]formate Formula: C10H10F3NO2S2 MolecularWeight: 297.31711

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Descriptors Computed from Structure

Canonical SMILES:

CS[N+](C1=CC=CC=C1C(F)(F)F)(C(=O)[O-])SC

Isomeric SMILES

CS[N+](C1=CC=CC=C1C(F)(F)F)(C(=O)[O-])SC

InChI

InChI=1S/C10H10F3NO2S2/c1-17-14(18-2,9(15)16)8-6-4-3-5-7(8)10(11,12)13/h3-6H,1-2H3