2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-phenoxy-1-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]propan-1-one Formula: C20H21F3N2O4S MolecularWeight: 442.45195

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)OC3=CC=CC=C3

InChI

InChI=1S/C20H21F3N2O4S/c1-15(29-17-7-3-2-4-8-17)19(26)24-10-12-25(13-11-24)30(27,28)18-9-5-6-16(14-18)20(21,22)23/h2-9,14-15H,10-13H2,1H3