tert-butyl N-[(3S,4S,6R)-4-oxidanyl-6-tridecyl-piperidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S,4S,6R)-4-oxidanyl-6-tridecyl-piperidin-3-yl]carbamate Openeye Name: tert-butyl N-[(3S,4S,6R)-4-hydroxy-6-tridecyl-3-piperidyl]carbamate CAS Name: N-[(3S,4S,6R)-4-hydroxy-6-tridecyl-3-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S,4S,6R)-4-hydroxy-6-tridecylpiperidin-3-yl]carbamate Traditional Name: N-[(3S,4S,6R)-4-hydroxy-6-tridecyl-3-piperidyl]carbamic acid tert-butyl ester Formula: C23H46N2O3 MolecularWeight: 398.62294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1CC(C(CN1)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCC[C@@H]1C[C@@H]([C@H](CN1)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C23H46N2O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-19-17-21(26)20(18-24-19)25-22(27)28-23(2,3)4/h19-21,24,26H,5-18H2,1-4H3,(H,25,27)/t19-,20+,21+/m1/s1