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FHH

Summary
Name:methyl 4-[(2-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[b]pyridin-3-yl)carbonylamino]butanoate
Formula:C14 H18 N2 O4
Formal charge:0
Formula weight:278.304 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6methyl 4-[(2-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[b]pyridin-3-yl)carbonylamino]butanoate

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C14H18N2O4/c1-20-12(17)6-3-7-15-13(18)10-8-9-4-2-5-11(9)16-14(10)19/h8H,2-7H2,1H3,(H,15,18)(H,16,19)
InChIKeyInChI1.03LFOKUSURFOQCKJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O
SMILESCACTVS3.385COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O
SMILES_CANONICALOpenEye OEToolkits2.0.6COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O
SMILESOpenEye OEToolkits2.0.6COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O

218853

PDB entries from 2024-04-24

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