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compound 0225238

PropertiesImage
MNX_IDMNXM1193820 Image of MNXM1193820
referenceenvipathM:...e1d371944385
formulaC20H17FNO5
global charge-1
mol weight370.356
InChIKeyBKPNHPKMDFEWBF-UHFFFAOYSA-M
InChIInChI=1S/C20H18FNO5/c1-9(2)17-16(20(26)27)15(11-7-13(23)19(25)14(24)8-11)18(22-17)10-3-5-12(21)6-4-10/h3-9,22-25H,1-2H3,(H,26,27)/p-1
SMILESCC(C)C1=C(C(=O)[O-])C(C2=CC(O)=C(O)C(O)=C2)=C(C2=CC=C(F)C=C2)N1
MNX internals
InChI (mnx)InChI=1/C20H18FNO5/c1-9(2)17-16(20(26)27)15(11-7-13(23)19(25)14(24)8-11)18(22-17)10-3-5-12(21)6-4-10/h3-9,22-25H,1-2H3,(H,26,27) Image of MNXM1193820
SMILES (mnx)[CH3:1][CH:9]([CH3:2])[C:17]1=[C:16]([C:20](=[O:26])[OH:27])[C:15]([C:11]2=[CH:7][C:13]([OH:23])=[C:19]([OH:25])[C:14]([OH:24])=[CH:8]2)=[C:18]([C:10]2=[CH:4][CH:6]=[C:12]([F:21])[CH:5]=[CH:3]2)[NH:22]1
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:...e1d371944385
envipathM:...e1d371944385
BKPNHPKMDFEWBF-UHFFFAOYSA-M
compound 0225238