ethyl 1-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]amino]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoyl]isonipecotic acid ethyl ester Formula: C17H19F3N2O5 MolecularWeight: 388.33837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

InChI

InChI=1S/C17H19F3N2O5/c1-2-25-14(23)11-7-9-22(10-8-11)15(24)21-17(16(18,19)20)26-12-5-3-4-6-13(12)27-17/h3-6,11H,2,7-10H2,1H3,(H,21,24)