Chem
J-GLOBAL ID：200907093025526960   Nikkaji number：J10.816B

Celabenzine

セラベンジン
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： C23H29N3O2
Molecular formula furigana： C23-H29-N3-O2
Molecular weight： 379.504
InChI： InChI=1S/C23H29N3O2/c27-22-18-21(19-10-3-1-4-11-19)24-14-7-8-16-26(17-9-15-25-22)23(28)20-12-5-2-6-13-20/h1-6,10-13,21,24H,7-9,14-18H2,(H,25,27)
InChI key： LSYKFBZWBDMZLQ-UHFFFAOYSA-N
SMILES： O=C(N1CCCCNC(CC(=O)NCCC1)c1ccccc1)c1ccccc1
Systematic name  (2)：
  • 9-ベンゾイル-2-フェニル-1,5,9-トリアザシクロトリデカン-4-オン
  • 9-benzoyl-2-phenyl-1,5,9-triazacyclotridecan-4-one
Other name (3)：
  • セラベンジン
  • Celabenzine
  • 9-Benzoyl-2-phenyl-1,5,9-triazacyclotridecan-4-one
CAS registry number： 53938-08-2
KEGG COMPOUND： C10578
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