Products 1216444-13-1

CAS 1216444-13-1 is the registry number for rac Cetirizine-d8 N-Oxide. Offered by: TRC. Available pack sizes: 2,5mg.

Structural formula: {0} (CAS {1})

2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-2,2,3,3,5,5,6,6-octadeuterio-1-oxidopiperazin-1-ium-1-yl]ethoxy]acetic acid (CAS 1216444-13-1) is a chemical compound with the molecular formula C21H25ClN2O4 and a molecular weight of 412.9 g/mol. IUPAC name: 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-2,2,3,3,5,5,6,6-octadeuterio-1-oxidopiperazin-1-ium-1-yl]ethoxy]acetic acid. InChIKey: IVDOUUOLLFEMJQ-BGKXKQMNSA-N.

Identity
Molecular formulaC21H25ClN2O4
Molecular weight412.9 g/mol
IUPAC name2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-2,2,3,3,5,5,6,6-octadeuterio-1-oxidopiperazin-1-ium-1-yl]ethoxy]acetic acid
InChIKeyIVDOUUOLLFEMJQ-BGKXKQMNSA-N
SMILES[2H]C1(C([N+](C(C(N1C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)([2H])[2H])([2H])[2H])(CCOCC(=O)O)[O-])([2H])[2H])[2H]

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