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NOO

Summary
Name:N-(3-oxocyclohex-1-en-1-yl)octanamide
Formula:C14 H23 N O2
Formal charge:0
Formula weight:237.338 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-(3-oxocyclohex-1-en-1-yl)octanamide
OpenEye OEToolkits1.7.0N-(3-oxocyclohexen-1-yl)octanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1C=C(NC(=O)CCCCCCC)CCC1
SMILES_CANONICALCACTVS3.370CCCCCCCC(=O)NC1=CC(=O)CCC1
SMILESCACTVS3.370CCCCCCCC(=O)NC1=CC(=O)CCC1
SMILES_CANONICALOpenEye OEToolkits1.7.0CCCCCCCC(=O)NC1=CC(=O)CCC1
SMILESOpenEye OEToolkits1.7.0CCCCCCCC(=O)NC1=CC(=O)CCC1
InChIInChI1.03InChI=1S/C14H23NO2/c1-2-3-4-5-6-10-14(17)15-12-8-7-9-13(16)11-12/h11H,2-10H2,1H3,(H,15,17)
InChIKeyInChI1.03USNFUKCPLYEHLS-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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