1-[bis(fluoranyl)-phenylsulfanyl-methyl]-4-nitro-benzene

Systemtic Name: 1-[bis(fluoranyl)-phenylsulfanyl-methyl]-4-nitro-benzene Openeye Name: 1-[difluoro(phenylsulfanyl)methyl]-4-nitro-benzene CAS Name: 1-[difluoro-(phenylthio)methyl]-4-nitrobenzene IUPAC Name: 1-[difluoro(phenylsulfanyl)methyl]-4-nitrobenzene Traditional Name: 1-[difluoro-(phenylthio)methyl]-4-nitro-benzene Formula: C13H9F2NO2S MolecularWeight: 281.277866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(C2=CC=C(C=C2)[N+](=O)[O-])(F)F

Isomeric SMILES

C1=CC=C(C=C1)SC(C2=CC=C(C=C2)[N+](=O)[O-])(F)F

InChI

InChI=1S/C13H9F2NO2S/c14-13(15,19-12-4-2-1-3-5-12)10-6-8-11(9-7-10)16(17)18/h1-9H