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Summary

Name:(2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
Formula:C17 H13 Cl N2 O4
Formal charge:0
Molecular weight:344.749 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
OpenEye OEToolkits2.0.6(2~{R})-2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OC(=O)C(Oc3ccc(Oc2nc1c(cc(cc1)Cl)nc2)cc3)C
InChIInChI1.03InChI=1S/C17H13ClN2O4/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-15-8-11(18)2-7-14(15)20-16/h2-10H,1H3,(H,21,22)/t10-/m1/s1
InChIKeyInChI1.03ABOOPXYCKNFDNJ-SNVBAGLBSA-N
SMILES_CANONICALCACTVS3.385C[C@@H](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(O)=O
SMILESCACTVS3.385C[CH](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C[C@H](C(=O)O)Oc1ccc(cc1)Oc2cnc3cc(ccc3n2)Cl
SMILESOpenEye OEToolkits2.0.6CC(C(=O)O)Oc1ccc(cc1)Oc2cnc3cc(ccc3n2)Cl