Chem
J-GLOBAL ID:200907050558721410   Nikkaji number:J1.537.889A

2-(4-Oxylatobutyl)-7-(4-hydroxybutyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone

2-(4-オキシラトブチル)-7-(4-ヒドロキシブチル)ベンゾ[lmn][3,8]フェナントロリン-1,3,6,8(2H,7H)-テトラオン
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: C22H21N2O5[O-]
Molecular formula furigana: C22-H21-N2-O6
Molecular weight: 409.419
InChI: InChI=1S/C22H21N2O6/c25-11-3-1-9-23-19(27)13-5-7-15-18-16(8-6-14(17(13)18)20(23)28)22(30)24(21(15)29)10-2-4-12-26/h5-8,25H,1-4,9-12H2/q-1
InChI key: KHJPJDUWSGHGLS-UHFFFAOYSA-N
SMILES: OCCCCn1c(=O)c2ccc3c4c(ccc(c24)c1=O)c(=O)n(CCCC[O-])c3=O
Systematic name  (3):
  • 2-(4-オキシラトブチル)-7-(4-ヒドロキシブチル)ベンゾ[lmn][3,8]フェナントロリン-1,3,6,8(2H,7H)-テトラオン
  • 4-[13-(4-ヒドロキシブチル)-5,7,12,14-テトラオキソ-6,13-ジアザテトラシクロ[6.6.2.04,16.011,15]ヘキサデカ-1,3,8,10,15-ペンタエン-6-イル]ブタン-1-オラート
  • 4-[13-(4-hydroxybutyl)-5,7,12,14-tetraoxo-6,13-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1,3,8,10,15-pentaen-6-yl]butan-1-olate
Other name (1):
  • 2-(4-Oxylatobutyl)-7-(4-hydroxybutyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone
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