Chem
J-GLOBAL ID：200907042049811262   Nikkaji number：J2.433.825H

(1S)-N-Methyl-1β,4β-(nitrosoimino)-6-(trifluoromethyl)tetralin-2α,3α-dicarbimide

(1S)-N-メチル-1β,4β-(ニトロソイミノ)-6-(トリフルオロメチル)テトラリン-2α,3α-ジカルボイミド
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： C14H10F3N3O3
Molecular formula furigana： C14-H10-F3-N3-O3
Molecular weight： 325.247
InChI： InChI=1S/C14H10F3N3O3/c1-19-12(21)8-9(13(19)22)11-7-4-5(14(15,16)17)2-3-6(7)10(8)20(11)18-23/h2-4,8-11H,1H3/t8-,9+,10-,11+/m1/s1
InChI key： AVGQUBKMSLNDFF-YTWAJWBKSA-N
SMILES： CN1C(=O)[C@@H]2[C@@H]([C@H]3N(N=O)[C@@H]2c2ccc(cc32)C(F)(F)F)C1=O
Systematic name  (3)：
  • (1S)-N-メチル-1β,4β-(ニトロソイミノ)-6-(トリフルオロメチル)テトラリン-2α,3α-ジカルボイミド
  • (1R,8S,9R,13S)-11-メチル-14-ニトロソ-4-(トリフルオロメチル)-11,14-ジアザテトラシクロ[6.5.1.02,7.09,13]テトラデカ-2,4,6-トリエン-10,12-ジオン
  • (1R,8S,9R,13S)-11-methyl-14-nitroso-4-(trifluoromethyl)-11,14-diazatetracyclo[6.5.1.02,7.09,13]tetradeca-2,4,6-triene-10,12-dione
Other name (1)：
  • (1S)-N-Methyl-1β,4β-(nitrosoimino)-6-(trifluoromethyl)tetralin-2α,3α-dicarbimide
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