[2-[4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperazin-1-yl]phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-[4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperazin-1-yl]phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-[4-(2-indan-1-ylethyl)piperazin-1-yl]phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-[4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-1-piperazinyl]phenyl] ester IUPAC Name: [2-[4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperazin-1-yl]phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-[4-(2-indan-1-ylethyl)piperazino]phenyl] ester Formula: C22H25F3N2O3S MolecularWeight: 454.50571

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1CCN3CCN(CC3)C4=CC=CC=C4OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1CC2=CC=CC=C2C1CCN3CCN(CC3)C4=CC=CC=C4OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C22H25F3N2O3S/c23-22(24,25)31(28,29)30-21-8-4-3-7-20(21)27-15-13-26(14-16-27)12-11-18-10-9-17-5-1-2-6-19(17)18/h1-8,18H,9-16H2