tert-butyl 4-[2-(4-methoxy-2,6-dimethyl-phenyl)-2-oxidanyl-ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-methoxy-2,6-dimethyl-phenyl)-2-oxidanyl-ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-hydroxy-2-(4-methoxy-2,6-dimethyl-phenyl)ethyl]piperidine-1-carboxylate CAS Name: 4-[2-hydroxy-2-(4-methoxy-2,6-dimethylphenyl)ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-hydroxy-2-(4-methoxy-2,6-dimethylphenyl)ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-hydroxy-2-(4-methoxy-2,6-dimethyl-phenyl)ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H33NO4 MolecularWeight: 363.49102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(CC2CCN(CC2)C(=O)OC(C)(C)C)O)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1C(CC2CCN(CC2)C(=O)OC(C)(C)C)O)C)OC

InChI

InChI=1S/C21H33NO4/c1-14-11-17(25-6)12-15(2)19(14)18(23)13-16-7-9-22(10-8-16)20(24)26-21(3,4)5/h11-12,16,18,23H,7-10,13H2,1-6H3