HH6

3-(4-hydroxyphenyl)-1H-indazol-6-ol

Created: 2012-04-04
Last modified:  2012-04-04

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count29
Aromatic Bond Count16
2D diagram of HH6

Chemical Component Summary

Name3-(4-hydroxyphenyl)-1H-indazol-6-ol
Systematic Name (OpenEye OEToolkits)3-(4-hydroxyphenyl)-1H-indazol-6-ol
FormulaC13 H10 N2 O2
Molecular Weight226.231
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01n2c(c1ccc(O)cc1n2)c3ccc(O)cc3
SMILESCACTVS3.370Oc1ccc(cc1)c2n[nH]c3cc(O)ccc23
SMILESOpenEye OEToolkits1.7.6c1cc(ccc1c2c3ccc(cc3[nH]n2)O)O
Canonical SMILESCACTVS3.370 Oc1ccc(cc1)c2n[nH]c3cc(O)ccc23
Canonical SMILESOpenEye OEToolkits1.7.6 c1cc(ccc1c2c3ccc(cc3[nH]n2)O)O
InChIInChI1.03 InChI=1S/C13H10N2O2/c16-9-3-1-8(2-4-9)13-11-6-5-10(17)7-12(11)14-15-13/h1-7,16-17H,(H,14,15)
InChIKeyInChI1.03 MUAYFXCYAHFDBS-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 135566717
ChEMBL CHEMBL2042885