[1-[5-ethyl-3-(trifluoromethyl)pyridin-2-yl]oxy-3-(propan-2-ylamino)propan-2-yl] undecanoate

Systemtic Name: [1-[5-ethyl-3-(trifluoromethyl)pyridin-2-yl]oxy-3-(propan-2-ylamino)propan-2-yl] undecanoate Openeye Name: [1-[[5-ethyl-3-(trifluoromethyl)-2-pyridyl]oxymethyl]-2-(isopropylamino)ethyl] undecanoate CAS Name: undecanoic acid [1-[[5-ethyl-3-(trifluoromethyl)-2-pyridinyl]oxy]-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-[5-ethyl-3-(trifluoromethyl)pyridin-2-yl]oxy-3-(propan-2-ylamino)propan-2-yl] undecanoate Traditional Name: undecanoic acid [1-[[5-ethyl-3-(trifluoromethyl)-2-pyridyl]oxymethyl]-2-(isopropylamino)ethyl] ester Formula: C25H41F3N2O3 MolecularWeight: 474.59985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC(CNC(C)C)COC1=C(C=C(C=N1)CC)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCC(=O)OC(CNC(C)C)COC1=C(C=C(C=N1)CC)C(F)(F)F

InChI

InChI=1S/C25H41F3N2O3/c1-5-7-8-9-10-11-12-13-14-23(31)33-21(17-29-19(3)4)18-32-24-22(25(26,27)28)15-20(6-2)16-30-24/h15-16,19,21,29H,5-14,17-18H2,1-4H3