97139-82-7 Purity
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Specification
The molecular formula of doxylamine N-oxide is C17H22N2O2.
The synonyms for doxylamine N-oxide include Doxylamine N'-Oxide, 97143-65-2, and 99430-77-0, QV5E5H59OS.
The molecular weight of doxylamine N-oxide is 286.37 g/mol.
Doxylamine N-oxide was created on November 3, 2014.
The last modification to doxylamine N-oxide was made on December 30, 2023.
The IUPAC Name of doxylamine N-oxide is N,N-dimethyl-2-[1-(1-oxidopyridin-1-ium-2-yl)-1-phenylethoxy]ethanamine.
The InChI of doxylamine N-oxide is InChI=1S/C17H22N2O2/c1-17(21-14-13-18(2)3,15-9-5-4-6-10-15)16-11-7-8-12-19(16)20/h4-12H,13-14H2,1-3H3.
The InChIKey of doxylamine N-oxide is MDIHSMRZIRBUPR-UHFFFAOYSA-N.
The canonical SMILES of doxylamine N-oxide is CC(C1=CC=CC=C1)(C2=CC=CC=[N+]2[O-])OCCN(C)C.
The CAS number of doxylamine N-oxide is 99430-77-0.