Chem
J-GLOBAL ID：201007038028255983   Nikkaji number：J2.824.215H

(1S,2S,4R,5S)-7β-[Hydroxybis(2-thienyl)acetoxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane

(1S,2S,4R,5S)-7β-[ヒドロキシビス(2-チエニル)アセトキシ]-9,9-ジメチル-3-オキサ-9-アゾニアトリシクロ[3.3.1.02,4]ノナン
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： C19H22[N+]O4S2
Molecular formula furigana： C19-H22-N-O4-S2
Molecular weight： 392.510
InChI： InChI=1S/C19H22NO4S2/c1-20(2)12-9-11(10-13(20)17-16(12)24-17)23-18(21)19(22,14-5-3-7-25-14)15-6-4-8-26-15/h3-8,11-13,16-17,22H,9-10H2,1-2H3/q+1/t11-,12-,13-,16-,17+/m0/s1
InChI key： LERNTVKEWCAPOY-UCQBOQSVSA-N
SMILES： C[N+]1(C)[C@H]2C[C@H](C[C@H]1[C@@H]1O[C@H]21)OC(=O)C(O)(c1cccs1)c1cccs1
Systematic name  (3)：
  • (1S,2S,4R,5S)-7β-[ヒドロキシビス(2-チエニル)アセトキシ]-9,9-ジメチル-3-オキサ-9-アゾニアトリシクロ[3.3.1.02,4]ノナン
  • (1S,2R,4S,5S,7S)-7-{[2-ヒドロキシ-2,2-ビス(チオフェン-2-イル)アセチル]オキシ}-9,9-ジメチル-3-オキサ-9-アザトリシクロ[3.3.1.02,4]ノナン-9-イウム
  • (1S,2R,4S,5S,7S)-7-{[2-hydroxy-2,2-bis(thiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-9-ium
Other name (1)：
  • (1S,2S,4R,5S)-7β-[Hydroxybis(2-thienyl)acetoxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane
Thsaurus map：
Thesaurus Map

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