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

Systemtic Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 1-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-[4-(2-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)15-5-3-4-14(12-15)13-18(26)23-8-10-24(11-9-23)31(29,30)17-7-2-1-6-16(17)25(27)28/h1-7,12H,8-11,13H2