7M9

1-pyrrolo[1,2-a]quinoxalin-4-ylnaphthalen-2-ol

Created: 2016-11-20
Last modified:  2016-12-28

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Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count0
Bond Count42
Aromatic Bond Count26
2D diagram of 7M9

Chemical Component Summary

Name1-pyrrolo[1,2-a]quinoxalin-4-ylnaphthalen-2-ol
Systematic Name (OpenEye OEToolkits)1-pyrrolo[1,2-a]quinoxalin-4-ylnaphthalen-2-ol
FormulaC21 H14 N2 O
Molecular Weight310.349
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Oc1ccc2ccccc2c1c3nc4ccccc4n5cccc35
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)ccc(c2c3c4cccn4c5ccccc5n3)O
Canonical SMILESCACTVS3.385 Oc1ccc2ccccc2c1c3nc4ccccc4n5cccc35
Canonical SMILESOpenEye OEToolkits2.0.6 c1ccc2c(c1)ccc(c2c3c4cccn4c5ccccc5n3)O
InChIInChI1.03 InChI=1S/C21H14N2O/c24-19-12-11-14-6-1-2-7-15(14)20(19)21-18-10-5-13-23(18)17-9-4-3-8-16(17)22-21/h1-13,24H
InChIKeyInChI1.03 IESKGGHNIDBTKX-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 137348646