Chem
J-GLOBAL ID：200907017643954605   Nikkaji number：J1.894.529K

(S)-(4-Methoxyphenyl)(benzylamino)acetonitrile

(S)-(4-メトキシフェニル)(ベンジルアミノ)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： C16H16N2O
Molecular formula furigana： C16-H16-N2-O
Molecular weight： 252.317
InChI： InChI=1S/C16H16N2O/c1-19-15-9-7-14(8-10-15)16(11-17)18-12-13-5-3-2-4-6-13/h2-10,16,18H,12H2,1H3/t16-/m1/s1
InChI key： SNFOVEHWKUQONB-MRXNPFEDSA-N
SMILES： COc1ccc(cc1)[C@H](NCc1ccccc1)C#N
Systematic name  (5)：
  • (αS)-α-(ベンジルアミノ)-4-メトキシベンゼンアセトニトリル
  • (S)-(4-メトキシフェニル)(ベンジルアミノ)アセトニトリル
  • (S)-α-シアノ-N-ベンジル-4-メトキシベンゼンメタンアミン
  • (2S)-2-(ベンジルアミノ)-2-(4-メトキシフェニル)アセトニトリル
  • (2S)-2-(benzylamino)-2-(4-methoxyphenyl)acetonitrile
Other name (3)：
  • (αS)-α-(Benzylamino)-4-methoxybenzeneacetonitrile
  • (S)-(4-Methoxyphenyl)(benzylamino)acetonitrile
  • (S)-α-Cyano-N-benzyl-4-methoxybenzenemethaneamine
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