[4-(4-ethanoylpiperazin-1-yl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-(4-acetylpiperazin-1-yl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-(4-acetyl-1-piperazinyl)phenyl] ester IUPAC Name: [4-(4-acetylpiperazin-1-yl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(4-acetylpiperazino)phenyl] ester Formula: C13H15F3N2O4S MolecularWeight: 352.32941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H15F3N2O4S/c1-10(19)17-6-8-18(9-7-17)11-2-4-12(5-3-11)22-23(20,21)13(14,15)16/h2-5H,6-9H2,1H3