2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]acetic acid Formula: C12H14F3N3O2 MolecularWeight: 289.25367

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H14F3N3O2/c13-12(14,15)9-1-2-10(16-7-9)18-5-3-17(4-6-18)8-11(19)20/h1-2,7H,3-6,8H2,(H,19,20)