tert-butyl 4-[4-(4-ethoxy-4-oxidanylidene-butan-2-yl)phenyl]-2-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-ethoxy-4-oxidanylidene-butan-2-yl)phenyl]-2-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(3-ethoxy-1-methyl-3-oxo-propyl)phenyl]-2-hydroxy-piperidine-1-carboxylate CAS Name: 4-[4-(4-ethoxy-4-oxobutan-2-yl)phenyl]-2-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-ethoxy-4-oxobutan-2-yl)phenyl]-2-hydroxypiperidine-1-carboxylate Traditional Name: 4-[4-(3-ethoxy-3-keto-1-methyl-propyl)phenyl]-2-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)C1=CC=C(C=C1)C2CCN(C(C2)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC(C)C1=CC=C(C=C1)C2CCN(C(C2)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33NO5/c1-6-27-20(25)13-15(2)16-7-9-17(10-8-16)18-11-12-23(19(24)14-18)21(26)28-22(3,4)5/h7-10,15,18-19,24H,6,11-14H2,1-5H3