(3-methoxycarbonylfuran-2-yl)methyl 1-[4-(trifluoromethyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: (3-methoxycarbonylfuran-2-yl)methyl 1-[4-(trifluoromethyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: (3-methoxycarbonyl-2-furyl)methyl 1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid (3-methoxycarbonyl-2-furanyl)methyl ester IUPAC Name: (3-methoxycarbonylfuran-2-yl)methyl 1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(trifluoromethyl)benzoyl]isonipecotic acid (3-carbomethoxy-2-furyl)methyl ester Formula: C21H20F3NO6 MolecularWeight: 439.38181

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(OC=C1)COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3NO6/c1-29-20(28)16-8-11-30-17(16)12-31-19(27)14-6-9-25(10-7-14)18(26)13-2-4-15(5-3-13)21(22,23)24/h2-5,8,11,14H,6-7,9-10,12H2,1H3