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

Systemtic Name: 4-methyl-3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide Formula: C16H13F3N2O3S MolecularWeight: 370.34623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2SCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H13F3N2O3S/c1-10-6-7-11(8-13(10)21(23)24)15(22)20-12-4-2-3-5-14(12)25-9-16(17,18)19/h2-8H,9H2,1H3,(H,20,22)