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QPM

Summary
Name:4-amino-2,2,6,6-tetramethylpiperidin-1-ol
Synonyms:4-Amino-TEMPO
Formula:C9 H19 N2 O
Formal charge:-1
Formula weight:171.26 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-amino-2,2,6,6-tetramethylpiperidin-1-olate
OpenEye OEToolkits2.0.72,2,6,6-tetramethyl-1-oxidanidyl-piperidin-4-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N1([O-])C(C)(C)CC(CC1(C)C)N
InChIInChI1.03InChI=1S/C9H19N2O/c1-8(2)5-7(10)6-9(3,4)11(8)12/h7H,5-6,10H2,1-4H3/q-1
InChIKeyInChI1.03RJXZKBIIOCNSSQ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC1(C)CC(N)CC(C)(C)N1[O-]
SMILESCACTVS3.385CC1(C)CC(N)CC(C)(C)N1[O-]
SMILES_CANONICALOpenEye OEToolkits2.0.7CC1(CC(CC(N1[O-])(C)C)N)C
SMILESOpenEye OEToolkits2.0.7CC1(CC(CC(N1[O-])(C)C)N)C

227344

PDB entries from 2024-11-13

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