Chem
J-GLOBAL ID：200907083204186149   Nikkaji number：J1.894.526F

(αS)-α-(Benzylamino)-3-nitrobenzeneacetonitrile

(αS)-α-(ベンジルアミノ)-3-ニトロベンゼンアセトニトリル
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： C15H13N2[N+]O[O-]
Molecular formula furigana： C15-H13-N3-O2
Molecular weight： 267.288
InChI： InChI=1S/C15H13N3O2/c16-10-15(17-11-12-5-2-1-3-6-12)13-7-4-8-14(9-13)18(19)20/h1-9,15,17H,11H2/t15-/m1/s1
InChI key： IWNXNOZDGMSPJC-OAHLLOKOSA-N
SMILES： [O-][N+](=O)c1cccc(c1)[C@H](NCc1ccccc1)C#N
Systematic name  (3)：
  • (αS)-α-(ベンジルアミノ)-3-ニトロベンゼンアセトニトリル
  • (2S)-2-(ベンジルアミノ)-2-(3-ニトロフェニル)アセトニトリル
  • (2S)-2-(benzylamino)-2-(3-nitrophenyl)acetonitrile
Other name (1)：
  • (αS)-α-(Benzylamino)-3-nitrobenzeneacetonitrile
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