Chem
J-GLOBAL ID：200907053881817493   Nikkaji number：J494.151I

ETH-2439

ETH-2439
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： C46H59N3O5
Molecular formula furigana： C46-H59-N3-O5
Molecular weight： 733.994
InChI： InChI=1S/C46H59N3O5/c1-5-7-19-37(20-8-6-2)53-44(50)23-15-13-11-9-10-12-14-18-30-52-45(51)31-34-24-26-35(27-25-34)47-41-33-43-46(39-22-17-16-21-38(39)41)48-40-29-28-36(49(3)4)32-42(40)54-43/h16-17,21-22,24-29,32-33,37H,5-15,18-20,23,30-31H2,1-4H3
InChI key： SWOXJPWUWJDGGP-UHFFFAOYSA-N
SMILES： CCCCC(CCCC)OC(=O)CCCCCCCCCCOC(=O)Cc1ccc(cc1)N=c1cc2oc3cc(ccc3nc2c2ccccc12)N(C)C
Systematic name  (4)：
  • 11-[[[4-[[9-(ジメチルアミノ)-5H-ベンゾ[a]フェノキサジン-5-イリデン]アミノ]フェニル]アセチル]オキシ]ウンデカン酸1-ブチルペンチル
  • [4-[[9-(ジメチルアミノ)-5H-ベンゾ[a]フェノキサジン-5-イリデン]アミノ]フェニル]酢酸11-(1-ブチルペントキシ)-11-オキソウンデシル
  • ノナン-5-イル 11-{[2-(4-{[8-(ジメチルアミノ)-12H-10-オキサ-5-アザテトラフェン-12-イリデン]アミノ}フェニル)アセチル]オキシ}ウンデカノアート
  • nonan-5-yl 11-{[2-(4-{[8-(dimethylamino)-12H-10-oxa-5-azatetraphen-12-ylidene]amino}phenyl)acetyl]oxy}undecanoate
Other name (3)：
  • ETH-2439
  • 11-[[[4-[[9-(Dimethylamino)-5H-benzo[a]phenoxazin-5-ylidene]amino]phenyl]acetyl]oxy]undecanoic acid 1-butylpentyl ester
  • [4-[[9-(Dimethylamino)-5H-benzo[a]phenoxazine-5-ylidene]amino]phenyl]acetic acid 11-(1-butylpentoxy)-11-oxoundecyl ester
Thsaurus map：
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