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CHEBI:108020 - 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
| Formula | C17H16ClNO3 |
| Net Charge | 0 |
| Average Mass | 317.772 |
| Monoisotopic Mass | 317.08187 |
| SMILES | COC(=O)c1c(C)nc(C(=O)C=Cc2cccc(Cl)c2)c1C |
| InChI | InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)8-7-12-5-4-6-13(18)9-12/h4-9,19H,1-3H3 |
| InChIKey | SSVIORHZXIQVDF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester (CHEBI:108020) has functional parent cinnamic acid (CHEBI:27386) |
| 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester (CHEBI:108020) is a olefinic compound (CHEBI:78840) |
| Manual Xrefs | Databases |
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| LSM-19397 | LINCS |