Chem
J-GLOBAL ID：200907079568369683   Nikkaji number：J2.518.275H

(3R)-1α-Methyl-2α,6α-ethano-3β-(methoxycarbonyl)-4α-(benzoyloxy)piperidinium

(3R)-1α-メチル-2α,6α-エタノ-3β-(メトキシカルボニル)-4α-(ベンゾイルオキシ)ピペリジニウム
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： C17H22[N+]O4
Molecular formula furigana： C17-H22-N-O4
Molecular weight： 304.365
InChI： InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/p+1/t12-,13+,14+,15+/m0/s1
InChI key： ZPUCINDJVBIVPJ-GBJTYRQASA-O
SMILES： COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@H]1OC(=O)c1ccccc1)[NH+]2C
Systematic name  (3)：
  • (3R)-1α-メチル-2α,6α-エタノ-3β-(メトキシカルボニル)-4α-(ベンゾイルオキシ)ピペリジニウム
  • (1R,2R,3R,5S)-3-(ベンゾイルオキシ)-2-(メトキシカルボニル)-8-メチル-8-アザビシクロ[3.2.1]オクタン-8-イウム
  • (1R,2R,3R,5S)-3-(benzoyloxy)-2-(methoxycarbonyl)-8-methyl-8-azabicyclo[3.2.1]octan-8-ium
Other name (1)：
  • (3R)-1α-Methyl-2α,6α-ethano-3β-(methoxycarbonyl)-4α-(benzoyloxy)piperidinium
Thsaurus map：
Thesaurus Map

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