Rupatadine N-Oxide

cas: 1704730-21-1 — see every product listed under this CAS number, including other names

Rupatadine N-Oxide (CAS 1704730-21-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-R459112
cas1704730-21-1
sizeon request
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Structural formula: {0} (CAS {1})

13-chloro-2-[1-[(5-methyl-1-oxidopyridin-1-ium-3-yl)methyl]piperidin-4-ylidene]-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene (CAS 1704730-21-1) is a chemical compound with the molecular formula C26H26ClN3O and a molecular weight of 432.0 g/mol. IUPAC name: 13-chloro-2-[1-[(5-methyl-1-oxidopyridin-1-ium-3-yl)methyl]piperidin-4-ylidene]-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene. InChIKey: KQTDHNFACRZETD-UHFFFAOYSA-N.

Identity
Molecular formulaC26H26ClN3O
Molecular weight432.0 g/mol
IUPAC name13-chloro-2-[1-[(5-methyl-1-oxidopyridin-1-ium-3-yl)methyl]piperidin-4-ylidene]-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
InChIKeyKQTDHNFACRZETD-UHFFFAOYSA-N
SMILESCC1=CC(=C[N+](=C1)[O-])CN2CCC(=C3C4=C(CCC5=C3N=CC=C5)C=C(C=C4)Cl)CC2

Computed by PubChem (NCBI)

Synonyms: Rupatadine N-oxide, Rupatadine impurity 7

Also listed as

Rupatadine N-Oxide (5-Methylpyridine N-Oxide) Chemat Brand CAS 1704730-21-1
Rupatadine Impurity 7 Hubei YoungXin CAS 1704730-21-1
Rupatadine N-oxide, >95% (HPLC) TRC CAS 1704730-21-1