Chem
J-GLOBAL ID：200907086361319380
Nikkaji number：J1.989.412F
2-(1H-Imidazole-4-ylmethyl)-3-oxobutyric acid ethyl ester
2-(1H-イミダゾール-4-イルメチル)-3-オキソ酪酸エチル
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： C10H14N2O3
Molecular formula furigana： C10-H14-N2-O3
Molecular weight： 210.233
InChI：
InChI=1S/C10H14N2O3/c1-3-15-10(14)9(7(2)13)4-8-5-11-6-12-8/h5-6,9H,3-4H2,1-2H3,(H,11,12)
InChI key：
HSXHGZDWARFZPG-UHFFFAOYSA-N
SMILES：
CCOC(=O)C(Cc1c[nH]cn1)C(=O)C
Systematic name (3)：
- 2-(1H-イミダゾール-4-イルメチル)-3-オキソ酪酸エチル
- エチル 2-[(1H-イミダゾール-4-イル)メチル]-3-オキソブタノアート
- ethyl 2-[(1H-imidazol-4-yl)methyl]-3-oxobutanoate
- 2-(1H-Imidazole-4-ylmethyl)-3-oxobutyric acid ethyl ester
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