3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide

Systemtic Name: 3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide Openeye Name: 3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide CAS Name: 3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide IUPAC Name: 3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide Traditional Name: 3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide Formula: C15H11F3N2O3S MolecularWeight: 356.31965

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11F3N2O3S/c16-15(17,18)9-24-13-7-2-1-6-12(13)19-14(21)10-4-3-5-11(8-10)20(22)23/h1-8H,9H2,(H,19,21)