Chem
J-GLOBAL ID:201107043506972581   Nikkaji number:J2.910.595B

3β-(1-Formylvinyl)-2-tosylisoindoline-1β-acetic acid methyl ester

3β-(1-ホルミルビニル)-2-トシルイソインドリン-1β-酢酸メチル
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: C21H21NO5S
Molecular formula furigana: C21-H21-N-O5-S
Molecular weight: 399.460
InChI: InChI=1S/C21H21NO5S/c1-14-8-10-16(11-9-14)28(25,26)22-19(12-20(24)27-3)17-6-4-5-7-18(17)21(22)15(2)13-23/h4-11,13,19,21H,2,12H2,1,3H3/t19-,21+/m1/s1
InChI key: PAVWGSNXIXPOKY-CTNGQTDRSA-N
SMILES: COC(=O)C[C@H]1N([C@@H](C(=C)C=O)c2ccccc12)S(=O)(=O)c1ccc(C)cc1
Systematic name  (3):
  • 3β-(1-ホルミルビニル)-2-トシルイソインドリン-1β-酢酸メチル
  • メチル 2-[(1R,3R)-2-(4-メチルベンゼンスルホニル)-3-(3-オキソプロパ-1-エン-2-イル)-2,3-ジヒドロ-1H-イソインドール-1-イル]アセタート
  • methyl 2-[(1R,3R)-2-(4-methylbenzenesulfonyl)-3-(3-oxoprop-1-en-2-yl)-2,3-dihydro-1H-isoindol-1-yl]acetate
Other name (1):
  • 3β-(1-Formylvinyl)-2-tosylisoindoline-1β-acetic acid methyl ester
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