O4-[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate

Systemtic Name: O4-[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate Openeye Name: O4-[2-(4-acetamido-2-fluoro-phenyl)-2-oxo-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] ester O1-tert-butyl ester IUPAC Name: 4-O-[2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] 1-O-tert-butyl piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-acetamido-2-fluoro-phenyl)-2-keto-ethyl] ester O1-tert-butyl ester Formula: C21H27FN2O6 MolecularWeight: 422.447283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C21H27FN2O6/c1-13(25)23-15-5-6-16(17(22)11-15)18(26)12-29-19(27)14-7-9-24(10-8-14)20(28)30-21(2,3)4/h5-6,11,14H,7-10,12H2,1-4H3,(H,23,25)