Chem
J-GLOBAL ID:200907035012634933   Nikkaji number:J1.278.479A

6-[(2-Cyanoethoxy)(diisopropylamino)phosphinooxy]-3′,6′-bis(2,2-dimethylpropionyloxy)spiro[isobenzofuran-1(3H),9′-[9H]xanthene]-3-one

6-[(2-シアノエトキシ)(ジイソプロピルアミノ)ホスフィノオキシ]-3′,6′-ビス(2,2-ジメチルプロピオニルオキシ)スピロ[イソベンゾフラン-1(3H),9′-[9H]キサンテン]-3-オン
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: C39H45N2O9P
Molecular formula furigana: C39-H45-N2-O9-P
Molecular weight: 716.768
InChI: InChI=1S/C39H45N2O9P/c1-23(2)41(24(3)4)51(45-19-11-18-40)50-27-12-15-28-31(20-27)39(49-34(28)42)29-16-13-25(46-35(43)37(5,6)7)21-32(29)48-33-22-26(14-17-30(33)39)47-36(44)38(8,9)10/h12-17,20-24H,11,19H2,1-10H3
InChI key: FMFIBLDMNYGACX-UHFFFAOYSA-N
SMILES: CC(C)N(C(C)C)P(OCCC#N)Oc1ccc2C(=O)OC3(c2c1)c1ccc(OC(=O)C(C)(C)C)cc1Oc1cc(OC(=O)C(C)(C)C)ccc31
Systematic name  (3):
  • 6-[(2-シアノエトキシ)(ジイソプロピルアミノ)ホスフィノオキシ]-3′,6′-ビス(2,2-ジメチルプロピオニルオキシ)スピロ[イソベンゾフラン-1(3H),9′-[9H]キサンテン]-3-オン
  • 6-({[ビス(プロパン-2-イル)アミノ](2-シアノエトキシ)ホスファニル}オキシ)-6'-[(2,2-ジメチルプロパノイル)オキシ]-3-オキソ-3H-スピロ[2-ベンゾフラン-1,9'-キサンテン]-3'-イル 2,2-ジメチルプロパノアート
  • 6-({[bis(propan-2-yl)amino](2-cyanoethoxy)phosphanyl}oxy)-6'-[(2,2-dimethylpropanoyl)oxy]-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-3'-yl 2,2-dimethylpropanoate
Other name (1):
  • 6-[(2-Cyanoethoxy)(diisopropylamino)phosphinooxy]-3′,6′-bis(2,2-dimethylpropionyloxy)spiro[isobenzofuran-1(3H),9′-[9H]xanthene]-3-one
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