Chem
J-GLOBAL ID:200907066458998524   Nikkaji number:J1.954.842B

3-(Diethyliminio)-6-(diethylamino)-9-[2-(piperazinocarbonyl)phenyl]-3H-xanthene

3-(ジエチルイミニオ)-6-(ジエチルアミノ)-9-[2-(ピペラジノカルボニル)フェニル]-3H-キサンテン
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: C32H39N3[N+]O2
Molecular formula furigana: C32-H39-N4-O2
Molecular weight: 511.689
InChI: InChI=1S/C32H39N4O2/c1-5-34(6-2)23-13-15-27-29(21-23)38-30-22-24(35(7-3)8-4)14-16-28(30)31(27)25-11-9-10-12-26(25)32(37)36-19-17-33-18-20-36/h9-16,21-22,33H,5-8,17-20H2,1-4H3/q+1
InChI key: SACFDVVXYCVUNL-UHFFFAOYSA-N
SMILES: CCN(CC)c1ccc2c(c3ccccc3C(=O)N3CCNCC3)c3ccc(=[N+](CC)CC)cc3oc2c1
Systematic name  (5):
  • N-エチル-N-[6-(ジエチルアミノ)-9-[2-(ピペラジノカルボニル)フェニル]-3H-キサンテン-3-イリデン]エタンアミニウム
  • 3-(ジエチルイミニオ)-6-(ジエチルアミノ)-9-[2-(ピペラジノカルボニル)フェニル]-3H-キサンテン
  • N,N-ジエチル-6-(ジエチルアミノ)-9-[2-(ピペラジノカルボニル)フェニル]-3H-キサンテン-3-イリデンイミニウム
  • 6-(ジエチルアミノ)-N,N-ジエチル-9-[2-(ピペラジン-1-カルボニル)フェニル]-3H-キサンテン-3-イミニウム
  • 6-(diethylamino)-N,N-diethyl-9-[2-(piperazine-1-carbonyl)phenyl]-3H-xanthen-3-iminium
Other name (3):
  • N-Ethyl-N-[6-(diethylamino)-9-[2-(piperazinocarbonyl)phenyl]-3H-xanthene-3-ylidene]ethanaminium
  • 3-(Diethyliminio)-6-(diethylamino)-9-[2-(piperazinocarbonyl)phenyl]-3H-xanthene
  • N,N-Diethyl-6-(diethylamino)-9-[2-(piperazinocarbonyl)phenyl]-3H-xanthene-3-ylideneiminium
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