Chem
J-GLOBAL ID：200907066679844076   Nikkaji number：J576.703B

Clozapine N-oxide

クロザピンN-オキシド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C18H19ClN3[N+][O-]
Molecular formula furigana： C18-H19-CL-N4-O
Molecular weight： 342.830
InChI： InChI=1S/C18H19ClN4O/c1-23(24)10-8-22(9-11-23)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
InChI key： OGUCZBIQSYYWEF-UHFFFAOYSA-N
SMILES： C[N+]1([O-])CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Systematic name  (4)：
  • 1-メチル-4-(8-クロロ-5H-ジベンゾ[b,e][1,4]ジアゼピン-11-イル)ピペラジン1-オキシド
  • 8-クロロ-11-[(4-メチルピペラジン4-オキシド)-1-イル]-5H-ジベンゾ[b,e][1,4]ジアゼピン
  • 4-{6-クロロ-2,9-ジアザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,9,11,13-ヘプタエン-10-イル}-1-メチルピペラジン-1-イウム-1-オラート
  • 4-{6-chloro-2,9-diazatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaen-10-yl}-1-methylpiperazin-1-ium-1-olate
Other name (3)：
  • クロザピンN-オキシド
  • Clozapine N-oxide
  • 8-Chloro-11-[(4-methylpiperazine 4-oxide)-1-yl]-5H-dibenzo[b,e][1,4]diazepine
CAS registry number： 34233-69-7
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