Methyl 3,4-Dichloro-5-nitrobenzoate - CAS 63105-53-3

Catalog: BB075978
Product Name: Methyl 3,4-Dichloro-5-nitrobenzoate
CAS: 63105-53-3
Synonyms: Methyl 3,4-dichloro-5-nitrobenzoate; Benzoic acid, 3,4-dichloro-5-nitro-, methyl ester; Methyl3,4-dichloro-5-nitrobenzoate
Methyl 3,4-Dichloro-5-nitrobenzoate
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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