QUJ

8-azanyl-4-(2-methylpropoxy)quinoline-2-carboxylic acid

Created: 2016-05-24
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count36
Aromatic Bond Count11
2D diagram of QUJ

Chemical Component Summary

Name8-azanyl-4-(2-methylpropoxy)quinoline-2-carboxylic acid
Systematic Name (OpenEye OEToolkits)8-azanyl-4-(2-methylpropoxy)quinoline-2-carboxylic acid
FormulaC14 H16 N2 O3
Molecular Weight260.288
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CC(C)COc1cc(nc2c(N)cccc12)C(O)=O
SMILESOpenEye OEToolkits2.0.5CC(C)COc1cc(nc2c1cccc2N)C(=O)O
Canonical SMILESCACTVS3.385 CC(C)COc1cc(nc2c(N)cccc12)C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.5 CC(C)COc1cc(nc2c1cccc2N)C(=O)O
InChIInChI1.03 InChI=1S/C14H16N2O3/c1-8(2)7-19-12-6-11(14(17)18)16-13-9(12)4-3-5-10(13)15/h3-6,8H,7,15H2,1-2H3,(H,17,18)
InChIKeyInChI1.03 UQMUZAYVJKDBFB-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 86002223