tert-butyl-[(2S)-2-oxidanyl-3-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxy-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-oxidanyl-3-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxy-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-3-[(1S,5R)-3,3,5-trimethylcyclohexoxy]propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-3-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxypropyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-3-[(1S,5R)-3,3,5-trimethylcyclohexyl]oxypropyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-3-[(1S,5R)-3,3,5-trimethylcyclohexoxy]propyl]ammonium Formula: C16H34NO2+ MolecularWeight: 272.44666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OCC(C[NH2+]C(C)(C)C)O

Isomeric SMILES

C[C@H]1C[C@@H](CC(C1)(C)C)OC[C@H](C[NH2+]C(C)(C)C)O

InChI

InChI=1S/C16H33NO2/c1-12-7-14(9-16(5,6)8-12)19-11-13(18)10-17-15(2,3)4/h12-14,17-18H,7-11H2,1-6H3/p+1/t12-,13-,14-/m0/s1