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| IUPAC Name: | methyl 3,4-dichloro-5-nitrobenzoate |
| Description: | Methyl 3,4-Dichloro-5-nitrobenzoate may be useful in the preparation of macrocyclic bis-2,2'-azaindole derivs. as inhibitors of peptidylarginine deiminases. |
| Molecular Weight: | 250.04 |
| Molecular Formula: | C8H5Cl2NO4 |
| Canonical SMILES: | COC(=O)C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-] |
| InChI: | InChI=1S/C8H5Cl2NO4/c1-15-8(12)4-2-5(9)7(10)6(3-4)11(13)14/h2-3H,1H3 |
| InChI Key: | XHIKDBWLWFGQEC-UHFFFAOYSA-N |
| References: | Canales, Eda Y., et al. PCT Int. Appl., 1052pp. (2021). |
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