Chem
J-GLOBAL ID：200907000196419748
Nikkaji number：J1.796.746K
3-Methylene-4-[2-[2-(hydroxymethyl)-1,3-dithiane-2-yl]ethyl]piperidine-1-carboxylic acid tert-butyl ester
3-メチレン-4-[2-[2-(ヒドロキシメチル)-1,3-ジチアン-2-イル]エチル]ピペリジン-1-カルボン酸tert-ブチル
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： C18H31NO3S2
Molecular formula furigana： C18-H31-N-O3-S2
Molecular weight： 373.570
InChI：
InChI=1S/C18H31NO3S2/c1-14-12-19(16(21)22-17(2,3)4)9-7-15(14)6-8-18(13-20)23-10-5-11-24-18/h15,20H,1,5-13H2,2-4H3
InChI key：
BLCUSWDHLPXLND-UHFFFAOYSA-N
SMILES：
CC(C)(C)OC(=O)N1CCC(CCC2(CO)SCCCS2)C(=C)C1
Systematic name (3)：
- 3-メチレン-4-[2-[2-(ヒドロキシメチル)-1,3-ジチアン-2-イル]エチル]ピペリジン-1-カルボン酸tert-ブチル
- tert-ブチル 4-{2-[2-(ヒドロキシメチル)-1,3-ジチアン-2-イル]エチル}-3-メチリデンピペリジン-1-カルボキシラート
- tert-butyl 4-{2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl}-3-methylidenepiperidine-1-carboxylate
- 3-Methylene-4-[2-[2-(hydroxymethyl)-1,3-dithiane-2-yl]ethyl]piperidine-1-carboxylic acid tert-butyl ester
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