tert-butyl 3-[2-(2-methoxyphenyl)-3-oxidanyl-propyl]-3-oxidanyl-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-(2-methoxyphenyl)-3-oxidanyl-propyl]-3-oxidanyl-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-hydroxy-3-[3-hydroxy-2-(2-methoxyphenyl)propyl]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-hydroxy-3-[3-hydroxy-2-(2-methoxyphenyl)propyl]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-3-[3-hydroxy-2-(2-methoxyphenyl)propyl]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-hydroxy-3-[3-hydroxy-2-(2-methoxyphenyl)propyl]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C26H35NO5 MolecularWeight: 441.5598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)(CC(CO)C3=CC=CC=C3OC)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)(CC(CO)C3=CC=CC=C3OC)O

InChI

InChI=1S/C26H35NO5/c1-25(2,3)32-24(29)27-16-10-15-26(30,23(27)19-11-6-5-7-12-19)17-20(18-28)21-13-8-9-14-22(21)31-4/h5-9,11-14,20,23,28,30H,10,15-18H2,1-4H3