Chem
J-GLOBAL ID:200907073271470379
Nikkaji number:J1.356.288A
2-[5-[2-[2-[Bis(acetoxymethyl)amino]-5-fluorophenoxy]ethoxy]-6-[bis[2-oxo-2-(acetoxymethoxy)ethyl]amino]benzofuran-2-yl]oxazole-5-carboxylic acid acetoxymethyl ester
2-[5-[2-[2-[ビス(アセトキシメチル)アミノ]-5-フルオロフェノキシ]エトキシ]-6-[ビス[2-オキソ-2-(アセトキシメトキシ)エチル]アミノ]ベンゾフラン-2-イル]オキサゾール-5-カルボン酸アセトキシメチル
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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:
C39 H40 FN3 O20
Molecular formula furigana:
C39-H40-F-N3-O20
Molecular weight:
889.748
InChI:
InChI=1S/C39H40FN3O20/c1-22(44)54-17-43(18-55-23(2)45)29-7-6-28(40)12-33(29)53-9-8-52-32-10-27-11-34(38-41-14-35(63-38)39(51)61-21-58-26(5)48)62-31(27)13-30(32)42(15-36(49)59-19-56-24(3)46)16-37(50)60-20-57-25(4)47/h6-7,10-14H,8-9,15-21H2,1-5H3
InChI key:
RYISCRUOJWGYDW-UHFFFAOYSA-N
SMILES:
CC(=O)OCOC(=O)CN(CC(=O)OCOC(=O)C)c1cc2oc(cc2cc1OCCOc1cc(F)ccc1N(COC(=O)C)COC(=O)C)c1ncc(o1)C(=O)OCOC(=O)C
Systematic name (3):
2-[5-[2-[2-[ビス(アセトキシメチル)アミノ]-5-フルオロフェノキシ]エトキシ]-6-[ビス[2-オキソ-2-(アセトキシメトキシ)エチル]アミノ]ベンゾフラン-2-イル]オキサゾール-5-カルボン酸アセトキシメチル
(アセチルオキシ)メチル 2-({2-[(アセチルオキシ)メトキシ]-2-オキソエチル}[2-(5-{[(アセチルオキシ)メトキシ]カルボニル}-1,3-オキサゾール-2-イル)-5-[2-(2-{ビス[(アセチルオキシ)メチル]アミノ}-5-フルオロフェノキシ)エトキシ]-1-ベンゾフラン-6-イル]アミノ)アセタート
(acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[2-(5-{[(acetyloxy)methoxy]carbonyl}-1,3-oxazol-2-yl)-5-[2-(2-{bis[(acetyloxy)methyl]amino}-5-fluorophenoxy)ethoxy]-1-benzofuran-6-yl]amino)acetate
Other name (1):
2-[5-[2-[2-[Bis(acetoxymethyl)amino]-5-fluorophenoxy]ethoxy]-6-[bis[2-oxo-2-(acetoxymethoxy)ethyl]amino]benzofuran-2-yl]oxazole-5-carboxylic acid acetoxymethyl ester
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