Chem
J-GLOBAL ID:201107098252668410   Nikkaji number:J2.891.502K

(1β,4S)-4-(Methoxymethyl)-7-acetyl-7-azabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester

(1β,4S)-4-(メトキシメチル)-7-アセチル-7-アザビシクロ[2.2.1]ヘプタン-2α-カルボン酸メチル
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: C12H19NO4
Molecular formula furigana: C12-H19-N-O4
Molecular weight: 241.287
InChI: InChI=1S/C12H19NO4/c1-8(14)13-10-4-5-12(13,7-16-2)6-9(10)11(15)17-3/h9-10H,4-7H2,1-3H3/t9-,10-,12+/m1/s1
InChI key: SDRCUIDCCYGPAJ-FOGDFJRCSA-N
SMILES: COC[C@]12CC[C@H]([C@@H](C1)C(=O)OC)N2C(=O)C
Systematic name  (3):
  • (1β,4S)-4-(メトキシメチル)-7-アセチル-7-アザビシクロ[2.2.1]ヘプタン-2α-カルボン酸メチル
  • メチル (1R,2R,4S)-7-アセチル-4-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-2-カルボキシラート
  • methyl (1R,2R,4S)-7-acetyl-4-(methoxymethyl)-7-azabicyclo[2.2.1]heptane-2-carboxylate
Other name (1):
  • (1β,4S)-4-(Methoxymethyl)-7-acetyl-7-azabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester
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