1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butane-1,4-dione CAS Name: 1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butane-1,4-dione Traditional Name: 1-phenyl-4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]butane-1,4-dione Formula: C21H21F3N2O4S MolecularWeight: 454.46265

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H21F3N2O4S/c22-21(23,24)17-7-4-8-18(15-17)31(29,30)26-13-11-25(12-14-26)20(28)10-9-19(27)16-5-2-1-3-6-16/h1-8,15H,9-14H2