Chem
J-GLOBAL ID：200907089718884080   Nikkaji number：J1.954.839B

N-Ethyl-N-[6-(diethylamino)-9-[2-[4-(3-hydroxypropyl)piperazinocarbonyl]phenyl]-3H-xanthene-3-ylidene]ethanaminium

6-(ジエチルアミノ)-N,N-ジエチル-9-{2-[4-(3-ヒドロキシプロピル)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
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： C35H45N3[N+]O3
Molecular formula furigana： C35-H45-N4-O3
Molecular weight： 569.769
InChI： InChI=1S/C35H45N4O3/c1-5-37(6-2)26-14-16-30-32(24-26)42-33-25-27(38(7-3)8-4)15-17-31(33)34(30)28-12-9-10-13-29(28)35(41)39-21-19-36(20-22-39)18-11-23-40/h9-10,12-17,24-25,40H,5-8,11,18-23H2,1-4H3/q+1
InChI key： XHJFECFFRNUXQC-UHFFFAOYSA-N
SMILES： CCN(CC)c1ccc2c(c3ccccc3C(=O)N3CCN(CCCO)CC3)c3ccc(=[N+](CC)CC)cc3oc2c1
Systematic name  (3)：
  • N-エチル-N-[6-(ジエチルアミノ)-9-[2-[4-(3-ヒドロキシプロピル)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
  • 6-(ジエチルアミノ)-N,N-ジエチル-9-{2-[4-(3-ヒドロキシプロピル)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-[4-(3-hydroxypropyl)piperazine-1-carbonyl]phenyl}-3H-xanthen-3-iminium
Other name (1)：
  • N-Ethyl-N-[6-(diethylamino)-9-[2-[4-(3-hydroxypropyl)piperazinocarbonyl]phenyl]-3H-xanthene-3-ylidene]ethanaminium
Thsaurus map：
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