SJN

4-Hydroxy-7-methyl-1,8-naphthyridine-3-carboxylic acid

Created:2020-11-18
Last modified:  2021-05-19

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count0
Bond Count24
Aromatic Bond Count6
2D diagram of SJN

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Chemical Component Summary

Name4-Hydroxy-7-methyl-1,8-naphthyridine-3-carboxylic acid
Synonyms7-methyl-4-oxidanylidene-3~{H}-1,8-naphthyridine-3-carboxylic acid; 1,4-Dihydro-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid; 7-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid; 3-Carboxy-4-hydroxy-7-methyl-1,8-naphthyridine; 5373672
Systematic Name (OpenEye OEToolkits)7-methyl-4-oxidanylidene-1~{H}-1,8-naphthyridine-3-carboxylic acid
FormulaC10 H8 N2 O3
Molecular Weight204.182
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385Cc1ccc2C(=O)C(=CNc2n1)C(O)=O
SMILESOpenEye OEToolkits2.0.7Cc1ccc2c(n1)NC=C(C2=O)C(=O)O
Canonical SMILESCACTVS3.385 Cc1ccc2C(=O)C(=CNc2n1)C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1ccc2c(n1)NC=C(C2=O)C(=O)O
InChIInChI1.03 InChI=1S/C10H8N2O3/c1-5-2-3-6-8(13)7(10(14)15)4-11-9(6)12-5/h2-4H,1H3,(H,14,15)(H,11,12,13)
InChIKeyInChI1.03 WHJTTWIMQIGVJK-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 83266, 5373672