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LSM-6257

PropertiesImage
MNX_IDMNXM530528 Image of MNXM530528
referencechebi:95024
formulaC12H11ClN4O2
global charge0
mol weight278.699
InChIKeyAICKZRPQDLFSPA-UHFFFAOYSA-N
InChIInChI=1S/C12H11ClN4O2/c1-2-19-11(18)6-7-17-15-12(14-16-17)9-4-3-5-10(13)8-9/h3-8H,2H2,1H3
SMILESCCOC(=O)C=CN1N=NC(C2=CC(Cl)=CC=C2)=N1
MNX internals
InChI (mnx)InChI=1/C12H11ClN4O2/c1-2-19-11(18)6-7-17-15-12(14-16-17)9-4-3-5-10(13)8-9/h3-8H,2H2,1H3/b7-6? Image of MNXM530528
SMILES (mnx)[CH3:1][CH2:2][O:19][C:11]([CH:6]=[CH:7][N:17]1[N:15]=[C:12]([C:9]2=[CH:8][C:10]([Cl:13])=[CH:5][CH:3]=[CH:4]2)[N:14]=[N:16]1)=[O:18]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:95024
chebi:95024
AICKZRPQDLFSPA-UHFFFAOYSA-N
LSM-6257