tert-butyl 4-[4-(4-methylsulfonylphenyl)butyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-methylsulfonylphenyl)butyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-hydroxy-4-[4-(4-methylsulfonylphenyl)butyl]piperidine-1-carboxylate CAS Name: 4-hydroxy-4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-4-[4-(4-methylsulfonylphenyl)butyl]piperidine-1-carboxylate Traditional Name: 4-hydroxy-4-[4-(4-mesylphenyl)butyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H33NO5S MolecularWeight: 411.55542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CCCCC2=CC=C(C=C2)S(=O)(=O)C)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CCCCC2=CC=C(C=C2)S(=O)(=O)C)O

InChI

InChI=1S/C21H33NO5S/c1-20(2,3)27-19(23)22-15-13-21(24,14-16-22)12-6-5-7-17-8-10-18(11-9-17)28(4,25)26/h8-11,24H,5-7,12-16H2,1-4H3