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J0R

Summary
Name:[(2R)-1-(trimethyl-$l^4-azanyl)propan-2-yl] ethanoate
Formula:C8 H18 N O2
Formal charge:1
Formula weight:160.234 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7[(2~{R})-1-(trimethyl-$l^{4}-azanyl)propan-2-yl] ethanoate

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H18NO2/c1-7(11-8(2)10)6-9(3,4)5/h7H,6H2,1-5H3/t7-/m1/s1
InChIKeyInChI1.03TXPWCDJHFBRHES-SSDOTTSWSA-N
SMILES_CANONICALCACTVS3.385C[C@H](C[N](C)(C)C)OC(C)=O
SMILESCACTVS3.385C[CH](C[N](C)(C)C)OC(C)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C[C@H](C[N](C)(C)C)OC(=O)C
SMILESOpenEye OEToolkits2.0.7CC(C[N](C)(C)C)OC(=O)C

223532

PDB entries from 2024-08-07

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