1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-[4-(3-nitrophenyl)sulfonylpiperazino]-2-[3-(trifluoromethyl)phenyl]ethanone Formula: C19H18F3N3O5S MolecularWeight: 457.42353

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC(=CC=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18F3N3O5S/c20-19(21,22)15-4-1-3-14(11-15)12-18(26)23-7-9-24(10-8-23)31(29,30)17-6-2-5-16(13-17)25(27)28/h1-6,11,13H,7-10,12H2