Chem
J-GLOBAL ID:201207072181366610   Nikkaji number:J3.043.185E

Acetic acid (3S)-2-methyl-2′,4-dioxo-6α-(acetoxymethyl)-1,2,3aα,6,7,7aα-hexahydrospiro[pyrano[3,4-c]pyrrole-3(4H),3′-indoline]-7α-yl ester

酢酸(3S)-2-メチル-2′,4-ジオキソ-6α-(アセトキシメチル)-1,2,3aα,6,7,7aα-ヘキサヒドロスピロ[ピラノ[3,4-c]ピロール-3(4H),3′-インドリン]-7α-イル
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: C20H22N2O7
Molecular formula furigana: C20-H22-N2-O7
Molecular weight: 402.403
InChI: InChI=1S/C20H22N2O7/c1-10(23)27-9-15-17(28-11(2)24)12-8-22(3)20(16(12)18(25)29-15)13-6-4-5-7-14(13)21-19(20)26/h4-7,12,15-17H,8-9H2,1-3H3,(H,21,26)/t12-,15+,16+,17+,20+/m0/s1
InChI key: HTNJYJGECICOJO-UUJAYADBSA-N
SMILES: CN1C[C@H]2[C@H](C(=O)O[C@H](COC(=O)C)[C@@H]2OC(=O)C)[C@@]21C(=O)Nc1ccccc21
Systematic name  (3):
  • 酢酸(3S)-2-メチル-2′,4-ジオキソ-6α-(アセトキシメチル)-1,2,3aα,6,7,7aα-ヘキサヒドロスピロ[ピラノ[3,4-c]ピロール-3(4H),3′-インドリン]-7α-イル
  • [(3S,3'aS,6'R,7'R,7'aR)-7'-(アセチルオキシ)-2'-メチル-2,4'-ジオキソ-1,2,2',3'a,4',6',7',7'a-オクタヒドロ-1'H-スピロ[インドール-3,3'-ピラノ[3,4-c]ピロール]-6'-イル]メチル アセタート
  • [(3S,3'aS,6'R,7'R,7'aR)-7'-(acetyloxy)-2'-methyl-2,4'-dioxo-1,2,2',3'a,4',6',7',7'a-octahydro-1'H-spiro[indole-3,3'-pyrano[3,4-c]pyrrol]-6'-yl]methyl acetate
Other name (1):
  • Acetic acid (3S)-2-methyl-2′,4-dioxo-6α-(acetoxymethyl)-1,2,3aα,6,7,7aα-hexahydrospiro[pyrano[3,4-c]pyrrole-3(4H),3′-indoline]-7α-yl ester
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