Chemical Component Summary

Name4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM
Synonyms1-(2-HYDROXY-IMINOMETHYLPYRIDINIUM)-1-(4-CARBOXYAMINO)-PYRIDINIUM DIMETHYLETHER
Identifiers1-[[2-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]methoxymethyl]pyridin-1-ium-4-carboxamide
FormulaC14 H16 N4 O3
Molecular Weight288.302
TypeNON-POLYMER
Isomeric SMILESc1cc[n+](c(c1)\C=N\O)COC[n+]2ccc(cc2)C(=O)N
InChIInChI=1S/C14H14N4O3/c15-14(19)12-4-7-17(8-5-12)10-21-11-18-6-2-1-3-13(18)9-16-20/h1-9H,10-11H2,(H-,15,19)/p+2
InChIKeyFJZDLOMCEPUCII-UHFFFAOYSA-P

Chemical Details

Formal Charge2
Atom Count37
Chiral Atom Count0
Bond Count38
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 101826767, 135412778, 6818286, 91615, 135590423
ChEMBL CHEMBL385181
CCDC/CSD BIKRES01, FAKNIO