(2-azanyl-2-oxidanylidene-ethyl) 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]isonipecotic acid (2-amino-2-keto-ethyl) ester Formula: C14H15ClF3N3O3 MolecularWeight: 365.73541

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)N)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)N)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C14H15ClF3N3O3/c15-10-5-9(14(16,17)18)6-20-12(10)21-3-1-8(2-4-21)13(23)24-7-11(19)22/h5-6,8H,1-4,7H2,(H2,19,22)