OZG

[6-(3-methoxyphenoxy)-1-benzofuran-3-yl]acetic acid

Created:2019-07-22
Last modified:  2019-12-25

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Chemical Details

Formal Charge0
Atom Count36
Chiral Atom Count0
Bond Count38
Aromatic Bond Count16
2D diagram of OZG

Chemical Component Summary

Name[6-(3-methoxyphenoxy)-1-benzofuran-3-yl]acetic acid
Systematic Name (OpenEye OEToolkits)2-[6-(3-methoxyphenoxy)-1-benzofuran-3-yl]ethanoic acid
FormulaC17 H14 O5
Molecular Weight298.29
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c2c(cc1c(c(CC(O)=O)co1)c2)Oc3cc(OC)ccc3
SMILESCACTVS3.385COc1cccc(Oc2ccc3c(CC(O)=O)coc3c2)c1
SMILESOpenEye OEToolkits2.0.7COc1cccc(c1)Oc2ccc3c(c2)occ3CC(=O)O
Canonical SMILESCACTVS3.385 COc1cccc(Oc2ccc3c(CC(O)=O)coc3c2)c1
Canonical SMILESOpenEye OEToolkits2.0.7 COc1cccc(c1)Oc2ccc3c(c2)occ3CC(=O)O
InChIInChI1.03 InChI=1S/C17H14O5/c1-20-12-3-2-4-13(8-12)22-14-5-6-15-11(7-17(18)19)10-21-16(15)9-14/h2-6,8-10H,7H2,1H3,(H,18,19)
InChIKeyInChI1.03 UOSYUXUYPKFRGA-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 145714266