3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazino]propan-1-one Formula: C21H23F3N2O5S MolecularWeight: 472.47793

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H23F3N2O5S/c1-30-17-5-2-16(3-6-17)4-11-20(27)25-12-14-26(15-13-25)32(28,29)19-9-7-18(8-10-19)31-21(22,23)24/h2-3,5-10H,4,11-15H2,1H3