EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H27N3O3 |
| Net Charge | 0 |
| Average Mass | 333.432 |
| Monoisotopic Mass | 333.20524 |
| SMILES | CC(CC(=O)Nc1c(C)cc(C)cc1C)=NNC(=O)OC(C)(C)C |
| InChI | InChI=1S/C18H27N3O3/c1-11-8-12(2)16(13(3)9-11)19-15(22)10-14(4)20-21-17(23)24-18(5,6)7/h8-9H,10H2,1-7H3,(H,19,22)(H,21,23) |
| InChIKey | JRGFZXQPKSSHQD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[4-oxo-4-(2,4,6-trimethylanilino)butan-2-ylidene]amino]carbamic acid tert-butyl ester (CHEBI:120841) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32284 | LINCS |