EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H7NO2 |
| Net Charge | 0 |
| Average Mass | 149.149 |
| Monoisotopic Mass | 149.04768 |
| SMILES | CC(=O)N=C1C=CC(=O)C=C1 |
| InChI | InChI=1S/C8H7NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5H,1H3 |
| InChIKey | URNSECGXFRDEDC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-acetyl-1,4-benzoquinone imine (CHEBI:29132) has functional parent 1,4-benzoquinone imine (CHEBI:50192) |
| N-acetyl-1,4-benzoquinone imine (CHEBI:29132) is a ketoimine (CHEBI:55378) |
| N-acetyl-1,4-benzoquinone imine (CHEBI:29132) is a quinone imine (CHEBI:50193) |
| IUPAC Name |
|---|
| N-(4-oxocyclohexa-2,5-dien-1-ylidene)acetamide |
| Synonyms | Source |
|---|---|
| 4-Acetylimino-2,5-cyclohexadien-1-one | ChemIDplus |
| Acetimidoquinone | ChemIDplus |
| N-acetylbenzoquinoneimine | ChEBI |
| N-acetyl-p-benzoquinone imine | ChemIDplus |
| N-Acetyl-4-benzoquinoneimine | ChemIDplus |
| NAPQI | ChEBI |
| Registry Numbers | Sources |
|---|---|
| Beilstein:2435621 | Beilstein |
| CAS:50700-49-7 | ChemIDplus |