O1-tert-butyl O4-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C20H26ClNO6 MolecularWeight: 411.87654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C20H26ClNO6/c1-20(2,3)28-19(25)22-9-7-13(8-10-22)18(24)27-12-16(23)14-5-6-17(26-4)15(21)11-14/h5-6,11,13H,7-10,12H2,1-4H3