3-methyl-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: 3-methyl-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: 3-methyl-1-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: 3-methyl-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazino]but-2-en-1-one Formula: C16H19F3N2O4S MolecularWeight: 392.39327

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F)C

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F)C

InChI

InChI=1S/C16H19F3N2O4S/c1-12(2)11-15(22)20-7-9-21(10-8-20)26(23,24)14-5-3-13(4-6-14)25-16(17,18)19/h3-6,11H,7-10H2,1-2H3