2-nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene

Systemtic Name: 2-nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene Openeye Name: 2-nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene CAS Name: 2-nitro-1-(phenylthio)-4-(trifluoromethyl)benzene IUPAC Name: 2-nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene Traditional Name: 2-nitro-1-(phenylthio)-4-(trifluoromethyl)benzene Formula: C13H8F3NO2S MolecularWeight: 299.26833

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H8F3NO2S/c14-13(15,16)9-6-7-12(11(8-9)17(18)19)20-10-4-2-1-3-5-10/h1-8H