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compound 0059896

PropertiesImage
MNX_IDMNXM1177959 Image of MNXM1177959
referenceenvipathM:...d2e52200a09a
formulaC10H6F5N2O2
global charge-1
mol weight281.16
InChIKeyKKEFPICWHXMILG-IUYQGCFVSA-M
InChIInChI=1S/C10H7F5N2O2/c11-9(12)4-1-3(4)6-7(10(13,14)15)16-17(8(6)9)2-5(18)19/h3-4H,1-2H2,(H,18,19)/p-1/t3-,4+/m0/s1
SMILESO=C([O-])CN1N=C(C(F)(F)F)C2=C1C(F)(F)[C@@H]1C[C@H]21
MNX internals
InChI (mnx)InChI=1/C10H7F5N2O2/c11-9(12)4-1-3(4)6-7(10(13,14)15)16-17(8(6)9)2-5(18)19/h3-4H,1-2H2,(H,18,19)/t3-,4+/m0/s1 Image of MNXM1177959
SMILES (mnx)[CH2:1]1[C@H:3]2[C@@H:4]1[C:9]([F:11])([F:12])[C:8]1=[C:6]2[C:7]([C:10]([F:13])([F:14])[F:15])=[N:16][N:17]1[CH2:2][C:5](=[O:18])[OH:19]
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

envipath:...d2e52200a09a
envipathM:...d2e52200a09a
KKEFPICWHXMILG-IUYQGCFVSA-M
compound 0059896