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RWM

Summary
Name:(5S)-5-methyl-5-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-2,4-dione
Formula:C15 H14 N2 O3
Formal charge:0
Formula weight:270.283 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(5S)-5-methyl-5-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-2,4-dione
OpenEye OEToolkits2.0.6(5~{S})-5-methyl-5-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n2c(cc(CC1(C)NC(CC1=O)=O)o2)c3ccccc3
InChIInChI1.03InChI=1S/C15H14N2O3/c1-15(13(18)8-14(19)16-15)9-11-7-12(17-20-11)10-5-3-2-4-6-10/h2-7H,8-9H2,1H3,(H,16,19)/t15-/m0/s1
InChIKeyInChI1.03QYMOUPYIBHTJEC-HNNXBMFYSA-N
SMILES_CANONICALCACTVS3.385C[C@@]1(Cc2onc(c2)c3ccccc3)NC(=O)CC1=O
SMILESCACTVS3.385C[C]1(Cc2onc(c2)c3ccccc3)NC(=O)CC1=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C[C@@]1(C(=O)CC(=O)N1)Cc2cc(no2)c3ccccc3
SMILESOpenEye OEToolkits2.0.6CC1(C(=O)CC(=O)N1)Cc2cc(no2)c3ccccc3

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건을2024-07-17부터공개중

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