Chem
J-GLOBAL ID：200907012476492716
Nikkaji number：J2.111.510J
(1R)-2α-(Ethoxycarbonyl)-3β-[(1R,2E)-1-cyano-3-(tert-butyldimethylsiloxy)-2-propenyl]cyclopentane-1α-acetic acid ethyl ester
(1R)-2α-(エトキシカルボニル)-3β-[(1R,2E)-1-シアノ-3-(tert-ブチルジメチルシロキシ)-2-プロペニル]シクロペンタン-1α-酢酸エチル
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
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
Molecular formula： C22H37NO5Si
Molecular formula furigana： C22-H37-N-O5-SI
Molecular weight： 423.625
InChI：
InChI=1S/C22H37NO5Si/c1-8-26-19(24)14-16-10-11-18(20(16)21(25)27-9-2)17(15-23)12-13-28-29(6,7)22(3,4)5/h12-13,16-18,20H,8-11,14H2,1-7H3/b13-12+/t16-,17-,18-,20+/m1/s1
InChI key：
CVIHXUZJTKUTAK-IOIZVOMLSA-N
SMILES：
CCOC(=O)C[C@H]1CC[C@H]([C@H](/C=C/O[Si](C)(C)C(C)(C)C)C#N)[C@H]1C(=O)OCC
Systematic name (3)：
- (1R)-2α-(エトキシカルボニル)-3β-[(1R,2E)-1-シアノ-3-(tert-ブチルジメチルシロキシ)-2-プロペニル]シクロペンタン-1α-酢酸エチル
- エチル (1S,2R,5R)-2-[(1R,2E)-3-[(tert-ブチルジメチルシリル)オキシ]-1-シアノプロパ-2-エン-1-イル]-5-(2-エトキシ-2-オキソエチル)シクロペンタン-1-カルボキシラート
- ethyl (1S,2R,5R)-2-[(1R,2E)-3-[(tert-butyldimethylsilyl)oxy]-1-cyanoprop-2-en-1-yl]-5-(2-ethoxy-2-oxoethyl)cyclopentane-1-carboxylate
- (1R)-2α-(Ethoxycarbonyl)-3β-[(1R,2E)-1-cyano-3-(tert-butyldimethylsiloxy)-2-propenyl]cyclopentane-1α-acetic acid ethyl ester
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