Chem
J-GLOBAL ID：200907041452359870   Nikkaji number：J1.929.083B

(1R,3R,4S,7R,8R,11R)-3,11-Diphenyl-8-(3-nitrophenyl)-4-methyl-9-oxa-2-oxa-10-thia-5-azatricyclo[5.2.2.01,5]undecane-6-one

(1R,3R,4S,7R,8R,11R)-4-メチル-8-(3-ニトロフェニル)-3,11-ジフェニル-2,9-ジオキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-オン
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： C26H22N[N+]O4[O-]S
Molecular formula furigana： C26-H22-N2-O5-S
Molecular weight： 474.530
InChI： InChI=1S/C26H22N2O5S/c1-16-22(17-9-4-2-5-10-17)32-26-27(16)25(29)21(24(34-26)18-11-6-3-7-12-18)23(33-26)19-13-8-14-20(15-19)28(30)31/h2-16,21-24H,1H3/t16-,21-,22-,23-,24-,26-/m0/s1
InChI key： QVLLGNIRUWQXGM-VESCSPDJSA-N
SMILES： C[C@H]1[C@H](O[C@@]23O[C@H]([C@@H]([C@@H](S2)c2ccccc2)C(=O)N13)c1cccc(c1)[N+](=O)[O-])c1ccccc1
Systematic name  (3)：
  • (1R,3R,4S,7R,8R,11R)-3,11-ジフェニル-8-(3-ニトロフェニル)-4-メチル-9-オキサ-2-オキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-オン
  • (1R,3R,4S,7R,8R,11R)-4-メチル-8-(3-ニトロフェニル)-3,11-ジフェニル-2,9-ジオキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-オン
  • (1R,3R,4S,7R,8R,11R)-4-methyl-8-(3-nitrophenyl)-3,11-diphenyl-2,9-dioxa-10-thia-5-azatricyclo[5.2.2.01,5]undecan-6-one
Other name (1)：
  • (1R,3R,4S,7R,8R,11R)-3,11-Diphenyl-8-(3-nitrophenyl)-4-methyl-9-oxa-2-oxa-10-thia-5-azatricyclo[5.2.2.01,5]undecane-6-one
Thsaurus map：
Thesaurus Map

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