Chem
J-GLOBAL ID：200907057147879247   Nikkaji number：J355.415E

(E)-Doxepin

(E)-ドキセピン
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： C19H21NO
Molecular formula furigana： C19-H21-N-O
Molecular weight： 279.383
InChI： InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11+
InChI key： ODQWQRRAPPTVAG-GZTJUZNOSA-N
SMILES： CN(C)CC/C=C/1\c2ccccc2COc2ccccc12
Systematic name  (4)：
  • 3-[(11E)-ジベンゾ[b,e]オキセピン-11(6H)-イリデン]-N,N-ジメチル-1-プロパンアミン
  • N,N-ジメチル-3-[[(E)-6,11-ジヒドロジベンゾ[b,e]オキセピン]-11-イリデン]プロピルアミン
  • ジメチル({3-[(2E)-9-オキサトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-2-イリデン]プロピル})アミン
  • dimethyl({3-[(2E)-9-oxatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene]propyl})amine
Other name (6)：
  • (E)-ドキセピン
  • (E)-Doxepin
  • N,N-Dimethyl-3-[[(E)-6,11-dihydrodibenz[b,e]oxepin]-11-ylidene]propylamine
  • trans-ドキセピン
  • trans-Doxepin
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