GVH

1H-PYRROLO[2,3-B]PYRIDINE

Created: 2007-03-15
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count15
Chiral Atom Count0
Bond Count16
Aromatic Bond Count0
2D diagram of GVH

Chemical Component Summary

Name1H-PYRROLO[2,3-B]PYRIDINE
Systematic Name (OpenEye OEToolkits)1H-pyrrolo[2,3-b]pyridine
FormulaC7 H6 N2
Molecular Weight118.136
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04n1cccc2c1ncc2
SMILESCACTVS3.341[nH]1ccc2cccnc12
SMILESOpenEye OEToolkits1.5.0c1cc2cc[nH]c2nc1
Canonical SMILESCACTVS3.341 [nH]1ccc2cccnc12
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc2cc[nH]c2nc1
InChIInChI1.03 InChI=1S/C7H6N2/c1-2-6-3-5-9-7(6)8-4-1/h1-5H,(H,8,9)
InChIKeyInChI1.03 MVXVYAKCVDQRLW-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 9222
ChEMBL CHEMBL389685
CCDC/CSD LIYMIR, JESPAY01