Chem
J-GLOBAL ID:200907028185731210
Nikkaji number:J2.674.988C
2-[[(1E)-4-Ethoxy-4-oxo-1-butenyl]thio]-6,8-dimethylindolizine-1,3-dicarboxylic acid diethyl ester
2-[[(1E)-4-エトキシ-4-オキソ-1-ブテニル]チオ]-6,8-ジメチルインドリジン-1,3-ジカルボン酸ジエチル
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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:
C22 H27 NO6 S
Molecular formula furigana:
C22-H27-N-O6-S
Molecular weight:
433.520
InChI:
InChI=1S/C22H27NO6S/c1-6-27-16(24)10-9-11-30-20-17(21(25)28-7-2)18-15(5)12-14(4)13-23(18)19(20)22(26)29-8-3/h9,11-13H,6-8,10H2,1-5H3/b11-9+
InChI key:
NGFZDTRNFRBXMS-PKNBQFBNSA-N
SMILES:
CCOC(=O)C/C=C/Sc1c(C(=O)OCC)c2c(C)cc(C)cn2c1C(=O)OCC
Systematic name (3):
2-[[(1E)-4-エトキシ-4-オキソ-1-ブテニル]チオ]-6,8-ジメチルインドリジン-1,3-ジカルボン酸ジエチル
1,3-ジエチル 2-{[(1E)-4-エトキシ-4-オキソブタ-1-エン-1-イル]スルファニル}-6,8-ジメチルインドリジン-1,3-ジカルボキシラート
1,3-diethyl 2-{[(1E)-4-ethoxy-4-oxobut-1-en-1-yl]sulfanyl}-6,8-dimethylindolizine-1,3-dicarboxylate
Other name (1):
2-[[(1E)-4-Ethoxy-4-oxo-1-butenyl]thio]-6,8-dimethylindolizine-1,3-dicarboxylic acid diethyl ester
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