Chem
J-GLOBAL ID:200907074284939461
Nikkaji number:J721.767F
(S)-α-(Hydroxymethyl)benzeneacetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester
(S)-α-(ヒドロキシメチル)ベンゼン酢酸(8-メチル-8-アザビシクロ[3.2.1]オクタン-3-イル)
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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:
C17 H23 NO3
Molecular formula furigana:
C17-H23-N-O3
Molecular weight:
289.375
InChI:
InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13?,14?,15?,16-/m1/s1
InChI key:
RKUNBYITZUJHSG-LGGPCSOHSA-N
SMILES:
CN1C2CCC1CC(C2)OC(=O)[C@H](CO)c1ccccc1
Systematic name (3):
(S)-α-(ヒドロキシメチル)ベンゼン酢酸(8-メチル-8-アザビシクロ[3.2.1]オクタン-3-イル)
8-メチル-8-アザビシクロ[3.2.1]オクタン-3-イル (2S)-3-ヒドロキシ-2-フェニルプロパノアート
8-methyl-8-azabicyclo[3.2.1]octan-3-yl (2S)-3-hydroxy-2-phenylpropanoate
Other name (1):
(S)-α-(Hydroxymethyl)benzeneacetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester
Thsaurus map:
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