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bromuconazole

PropertiesImage
MNX_IDMNXM44800 Image of MNXM44800
referencechebi:81900
formulaC13H12BrCl2N3O
global charge0
mol weight377.069
InChIKeyHJJVPARKXDDIQD-UHFFFAOYSA-N
InChIInChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2
SMILESClC1=CC(Cl)=C(C2(CN3C=NC=N3)CC(Br)CO2)C=C1
MNX internals
InChI (mnx)InChI=1/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2/t9?,13? Image of MNXM44800
SMILES (mnx)[CH:1]1=[CH:2][C:11]([C:13]2([CH2:6][N:19]3[CH:8]=[N:17][CH:7]=[N:18]3)[CH2:4][CH:9]([Br:14])[CH2:5][O:20]2)=[C:12]([Cl:16])[CH:3]=[C:10]1[Cl:15]
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:81900
chebi:81900
HJJVPARKXDDIQD-UHFFFAOYSA-N 		bromuconazole
1-((4-Bromo-2-(2,4-dichlorophenyl)tetrahydro-2-furanyl)methyl)-1H-1,2,4-triazole
2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol

envipath:...9dd8e5aeade1
envipathM:...9dd8e5aeade1
envipath:...4515dc862f5b
envipathM:...4515dc862f5b
seed.compound:cpd19967
seedM:cpd19967
kegg.compound:C18704
keggC:C18704
HJJVPARKXDDIQD-UHFFFAOYSA-N 		Bromuconazole

keggC:M_C18704
seedM:M_cpd19967 		secondary/obsolete/fantasy identifier