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CHEBI:47096 - 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-BROMO-4-METHYLBENZENOLATE
| Formula | C15H13BrN4O |
| Net Charge | 0 |
| Average Mass | 345.200 |
| Monoisotopic Mass | 344.02727 |
| SMILES | [H]c1c(Br)c([O-])c(-c2nc3c([H])c(C(N([H])[H])=[N+]([H])[H])c([H])c([H])c3n2[H])c([H])c1C([H])([H])[H] |
| InChI | InChI=1S/C15H13BrN4O/c1-7-4-9(13(21)10(16)5-7)15-19-11-3-2-8(14(17)18)6-12(11)20-15/h2-6,21H,1H3,(H3,17,18)(H,19,20) |
| InChIKey | XKCHOMIJYLHXLI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-BROMO-4-METHYLBENZENOLATE (CHEBI:47096) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-BROMO-4-METHYLBENZENOLATE | PDBeChem |
| 2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-6-bromo-4-methylphenolate | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 334 | PDBeChem |