6-[[4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-(2,2,2-trifluoroethyl)-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-(2,2,2-trifluoroethyl)piperazino]methyl]sesamol Formula: C14H17F3N2O3 MolecularWeight: 318.29159

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)CC(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)CC(F)(F)F

InChI

InChI=1S/C14H17F3N2O3/c15-14(16,17)8-19-3-1-18(2-4-19)7-10-5-12-13(6-11(10)20)22-9-21-12/h5-6,20H,1-4,7-9H2