Chem
J-GLOBAL ID:200907052278338517
Nikkaji number:J2.706.399C
2-(3-Tosyl-2-propynyl)-2-(5,5-dimethyltetrahydrofuran-2-ylmethyl)malonic acid diethyl ester
2-(3-トシル-2-プロピニル)-2-(5,5-ジメチルテトラヒドロフラン-2-イルメチル)マロン酸ジエチル
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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:
C24 H32 O7 S
Molecular formula furigana:
C24-H32-O7-S
Molecular weight:
464.570
InChI:
InChI=1S/C24H32O7S/c1-6-29-21(25)24(22(26)30-7-2,17-19-13-15-23(4,5)31-19)14-8-16-32(27,28)20-11-9-18(3)10-12-20/h9-12,19H,6-7,13-15,17H2,1-5H3
InChI key:
WXRRQCYZSIBFDS-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC#CS(=O)(=O)c1ccc(C)cc1)(CC1CCC(C)(C)O1)C(=O)OCC
Systematic name (3):
2-(3-トシル-2-プロピニル)-2-(5,5-ジメチルテトラヒドロフラン-2-イルメチル)マロン酸ジエチル
1,3-ジエチル 2-[(5,5-ジメチルオキソラン-2-イル)メチル]-2-[3-(4-メチルベンゼンスルホニル)プロパ-2-イン-1-イル]プロパンジオアート
1,3-diethyl 2-[(5,5-dimethyloxolan-2-yl)methyl]-2-[3-(4-methylbenzenesulfonyl)prop-2-yn-1-yl]propanedioate
Other name (1):
2-(3-Tosyl-2-propynyl)-2-(5,5-dimethyltetrahydrofuran-2-ylmethyl)malonic acid diethyl ester
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