2-[[1-pyrimidin-4-yl-2-(trifluoromethyl)piperidin-4-yl]methylamino]ethanoate

Systemtic Name: 2-[[1-pyrimidin-4-yl-2-(trifluoromethyl)piperidin-4-yl]methylamino]ethanoate Openeye Name: 2-[[1-pyrimidin-4-yl-2-(trifluoromethyl)-4-piperidyl]methylamino]acetate CAS Name: 2-[[1-(4-pyrimidinyl)-2-(trifluoromethyl)-4-piperidinyl]methylamino]acetate IUPAC Name: 2-[[1-pyrimidin-4-yl-2-(trifluoromethyl)piperidin-4-yl]methylamino]acetate Traditional Name: 2-[[1-(4-pyrimidyl)-2-(trifluoromethyl)-4-piperidyl]methylamino]acetate Formula: C13H16F3N4O2- MolecularWeight: 317.28695

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1CNCC(=O)[O-])C(F)(F)F)C2=NC=NC=C2

Isomeric SMILES

C1CN(C(CC1CNCC(=O)[O-])C(F)(F)F)C2=NC=NC=C2

InChI

InChI=1S/C13H17F3N4O2/c14-13(15,16)10-5-9(6-18-7-12(21)22)2-4-20(10)11-1-3-17-8-19-11/h1,3,8-10,18H,2,4-7H2,(H,21,22)/p-1