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OQH

Summary
Name:~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide
Formula:C12 H15 N O2
Formal charge:0
Formula weight:205.253 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C12H15NO2/c1-2-13-12(15)9-8-11(14)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,15)
InChIKeyInChI1.03DSZHWKIWJYHWTO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCNC(=O)CCC(=O)c1ccccc1
SMILESCACTVS3.385CCNC(=O)CCC(=O)c1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.7CCNC(=O)CCC(=O)c1ccccc1
SMILESOpenEye OEToolkits2.0.7CCNC(=O)CCC(=O)c1ccccc1

222415

数据于2024-07-10公开中

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