1-(azetidin-3-yl)-4-piperidin-1-ylsulfonyl-piperazine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-(azetidin-3-yl)-4-piperidin-1-ylsulfonyl-piperazine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-(azetidin-3-yl)-4-(1-piperidylsulfonyl)piperazine; 2,2,2-trifluoroacetic acid CAS Name: 1-(3-azetidinyl)-4-(1-piperidinylsulfonyl)piperazine; 2,2,2-trifluoroacetic acid IUPAC Name: 1-(azetidin-3-yl)-4-piperidin-1-ylsulfonylpiperazine; 2,2,2-trifluoroacetic acid Traditional Name: 1-(azetidin-3-yl)-4-piperidinosulfonyl-piperazine; 2,2,2-trifluoroacetic acid Formula: C16H26F6N4O6S MolecularWeight: 516.456259

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)N2CCN(CC2)C3CNC3.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)N2CCN(CC2)C3CNC3.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C12H24N4O2S.2C2HF3O2/c17-19(18,15-4-2-1-3-5-15)16-8-6-14(7-9-16)12-10-13-11-12;2*3-2(4,5)1(6)7/h12-13H,1-11H2;2*(H,6,7)