Chem
J-GLOBAL ID：200907070455551755   Nikkaji number：J1.921.007C

2-Amino-3-(4-nitrophenylthio)propanoic acid benzyl ester

2-アミノ-3-(4-ニトロフェニルチオ)プロパン酸ベンジル
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： C16H16N[N+]O3[O-]S
Molecular formula furigana： C16-H16-N2-O4-S
Molecular weight： 332.370
InChI： InChI=1S/C16H16N2O4S/c17-15(16(19)22-10-12-4-2-1-3-5-12)11-23-14-8-6-13(7-9-14)18(20)21/h1-9,15H,10-11,17H2
InChI key： LGEFNOVAVYYPRP-UHFFFAOYSA-N
SMILES： NC(CSc1ccc(cc1)[N+](=O)[O-])C(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-アミノ-3-(4-ニトロフェニルチオ)プロパン酸ベンジル
  • ベンジル 2-アミノ-3-[(4-ニトロフェニル)スルファニル]プロパノアート
  • benzyl 2-amino-3-[(4-nitrophenyl)sulfanyl]propanoate
Other name (1)：
  • 2-Amino-3-(4-nitrophenylthio)propanoic acid benzyl ester
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