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Unknown2

PropertiesImage
MNX_IDMNXM22376 Image of MNXM22376
referenceenvipathM:...2e1d47ccadd1
formulaC11H14ClNO3
global charge0
mol weight243.69
InChIKeyIZPQESMSWSVMJJ-UHFFFAOYSA-N
InChIInChI=1S/C11H14ClNO3/c1-8(7-14)11(15)13(16)6-9-4-2-3-5-10(9)12/h2-5,8,14,16H,6-7H2,1H3
SMILESCC(CO)C(=O)N(O)Cc1ccccc1Cl
MNX internals
InChI (mnx)InChI=1/C11H14ClNO3/c1-8(7-14)11(15)13(16)6-9-4-2-3-5-10(9)12/h2-5,8,14,16H,6-7H2,1H3/t8? Image of MNXM22376
SMILES (mnx)[CH3:1][CH:2]([CH2:3][CH3:4])[C:5](=[CH2:6])[CH:7]([CH2:8][C:9]1=[C:10]([OH:15])[CH:11]=[Cl:12][N:13]=[O:14]1)[OH:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

envipath:...357be6286322
envipathM:...357be6286322
envipath:...2e1d47ccadd1
envipathM:...2e1d47ccadd1
IZPQESMSWSVMJJ-UHFFFAOYSA-N 		Unknown2

bigg.metabolite:unk2_BS
biggM:unk2_BS 		Unknown 2

seed.compound:cpd15645
seedM:cpd15645 		unknown 2
unk2_BS

biggM:M_unk2_BS
seedM:M_cpd15645 		secondary/obsolete/fantasy identifier