Chem
J-GLOBAL ID：201107052960624910
Nikkaji number：J2.960.549A
N-(6-Acetylpyrene-1-yl)-β-alanine
N-(6-アセチルピレン-1-イル)-β-アラニン
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： C21H17NO3
Molecular formula furigana： C21-H17-N-O3
Molecular weight： 331.371
InChI：
InChI=1S/C21H17NO3/c1-12(23)15-6-2-13-4-8-17-18(22-11-10-19(24)25)9-5-14-3-7-16(15)20(13)21(14)17/h2-9,22H,10-11H2,1H3,(H,24,25)
InChI key：
YDWKKJIIRWITBQ-UHFFFAOYSA-N
SMILES：
CC(=O)c1ccc2ccc3c(NCCC(=O)O)ccc4ccc1c2c34
Systematic name (3)：
- N-(6-アセチルピレン-1-イル)-β-アラニン
- 3-[(6-アセチルピレン-1-イル)アミノ]プロパン酸
- 3-[(6-acetylpyren-1-yl)amino]propanoic acid
- N-(6-Acetylpyrene-1-yl)-β-alanine
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