Chem
J-GLOBAL ID：201307045082302677
Nikkaji number：J3.216.563J
2-Methylene-3-(tert-butoxycarbonyloxy)-3-(4-cyanophenyl)butanoic acid methyl ester
2-メチレン-3-(tert-ブトキシカルボニルオキシ)-3-(4-シアノフェニル)ブタン酸メチル
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： C18H21NO5
Molecular formula furigana： C18-H21-N-O5
Molecular weight： 331.368
InChI：
InChI=1S/C18H21NO5/c1-12(15(20)22-6)18(5,24-16(21)23-17(2,3)4)14-9-7-13(11-19)8-10-14/h7-10H,1H2,2-6H3
InChI key：
GBAFPITWIKUNLM-UHFFFAOYSA-N
SMILES：
COC(=O)C(=C)C(C)(OC(=O)OC(C)(C)C)c1ccc(cc1)C#N
Systematic name (3)：
- 2-メチレン-3-(tert-ブトキシカルボニルオキシ)-3-(4-シアノフェニル)ブタン酸メチル
- メチル 3-{[(tert-ブトキシ)カルボニル]オキシ}-3-(4-シアノフェニル)-2-メチリデンブタノアート
- methyl 3-{[(tert-butoxy)carbonyl]oxy}-3-(4-cyanophenyl)-2-methylidenebutanoate
- 2-Methylene-3-(tert-butoxycarbonyloxy)-3-(4-cyanophenyl)butanoic acid methyl ester
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