EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H24N2O6 |
| Net Charge | 0 |
| Average Mass | 388.420 |
| Monoisotopic Mass | 388.16344 |
| SMILES | COC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)C1c1cccc([N+](=O)[O-])c1 |
| InChI | InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-7-6-8-15(9-14)22(25)26/h6-9,11,18,21H,10H2,1-5H3 |
| InChIKey | MRSJBSHLMOBYSH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| m-Nisoldipine (CHEBI:181608) is a dihydropyridine (CHEBI:50075) |
| IUPAC Name |
|---|
| 3-O-methyl 5-O-(2-methylpropyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Manual Xrefs | Databases |
|---|---|
| 8267192 | ChemSpider |