EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H15Cl2N3O4 |
| Net Charge | 0 |
| Average Mass | 408.241 |
| Monoisotopic Mass | 407.04396 |
| SMILES | COC(=O)[C@](O)(Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1Cl |
| InChI | InChI=1S/C18H15Cl2N3O4/c1-26-17(24)18(25,9-23-11-21-10-22-23)15-7-6-14(8-16(15)20)27-13-4-2-12(19)3-5-13/h2-8,10-11,25H,9H2,1H3/t18-/m0/s1 |
| InChIKey | JABCRSAQEYNUAS-SFHVURJKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (R)-carmeconazole (CHEBI:235495) is a methyl 2-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoate (CHEBI:235497) |
| (R)-carmeconazole (CHEBI:235495) is enantiomer of (S)-carmeconazole (CHEBI:235496) |
| Incoming Relation(s) |
| carmeconazole (CHEBI:235494) has part (R)-carmeconazole (CHEBI:235495) |
| (S)-carmeconazole (CHEBI:235496) is enantiomer of (R)-carmeconazole (CHEBI:235495) |
| IUPAC Name |
|---|
| methyl (2R)-2-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoate |