Chem
J-GLOBAL ID:200907050605283117   Nikkaji number:J1.263.515J

10,20-Dibutyl-15-phenyl-21H,23H-porphyrin-5-butyronitrile

10,20-ジブチル-15-フェニル-21H,23H-ポルフィリン-5-ブチロニトリル
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: C38H39N5
Molecular formula furigana: C38-H39-N5
Molecular weight: 565.765
InChI: InChI=1S/C38H39N5/c1-3-5-14-27-30-17-19-32(40-30)29(16-10-11-25-39)33-20-18-31(41-33)28(15-6-4-2)35-22-24-37(43-35)38(26-12-8-7-9-13-26)36-23-21-34(27)42-36/h7-9,12-13,17-24,40,43H,3-6,10-11,14-16H2,1-2H3/b30-27-,31-28-,32-29-,33-29-,34-27-,35-28-,38-36-,38-37-
InChI key: YLPWDYZNTOERAB-YUEFZSJUSA-N
SMILES: CCCC/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/CCCC#N)[nH]4)/CCCC)/C=C3)\c1ccccc1)/[nH]2
Systematic name  (3):
  • 10,20-ジブチル-15-フェニル-21H,23H-ポルフィリン-5-ブチロニトリル
  • 4-{7,17-ジブチル-12-フェニル-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン-2-イル}ブタンニトリル
  • 4-{7,17-dibutyl-12-phenyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl}butanenitrile
Other name (1):
  • 10,20-Dibutyl-15-phenyl-21H,23H-porphyrin-5-butyronitrile
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