F6F

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Summary

Name:2-{[4-(TRIFLUOROMETHOXY)BENZOYL]AMINO}ETHYL DIHYDROGEN PHOSPHATE
Synonyms:N-(4'-TRIFLUOROMETHOXYBENZOYL)-2-AMINO-1-ETHYLPHOSPHATE, F6
Formula:C10 H11 F3 N O6 P
Formal charge:0
Molecular weight:329.166 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-({[4-(trifluoromethoxy)phenyl]carbonyl}amino)ethyl dihydrogen phosphate
OpenEye OEToolkits1.5.02-[[4-(trifluoromethoxy)phenyl]carbonylamino]ethyl dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04FC(F)(F)Oc1ccc(cc1)C(=O)NCCOP(=O)(O)O
SMILES_CANONICALCACTVS3.341O[P](O)(=O)OCCNC(=O)c1ccc(OC(F)(F)F)cc1
SMILESCACTVS3.341O[P](O)(=O)OCCNC(=O)c1ccc(OC(F)(F)F)cc1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(ccc1C(=O)NCCOP(=O)(O)O)OC(F)(F)F
SMILESOpenEye OEToolkits1.5.0c1cc(ccc1C(=O)NCCOP(=O)(O)O)OC(F)(F)F
InChIInChI1.03InChI=1S/C10H11F3NO6P/c11-10(12,13)20-8-3-1-7(2-4-8)9(15)14-5-6-19-21(16,17)18/h1-4H,5-6H2,(H,14,15)(H2,16,17,18)
InChIKeyInChI1.03YAHFSBJEYPSDPU-UHFFFAOYSA-N