Chem
J-GLOBAL ID:200907038961562004   Nikkaji number:J2.214.440E

N-[(2-Nitrophenyl)sulfonyl]-L-isoleucine methyl ester

N-[(2-ニトロフェニル)スルホニル]-L-イソロイシンメチル
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: C13H18N[N+]O5[O-]S
Molecular formula furigana: C13-H18-N2-O6-S
Molecular weight: 330.360
InChI: InChI=1S/C13H18N2O6S/c1-4-9(2)12(13(16)21-3)14-22(19,20)11-8-6-5-7-10(11)15(17)18/h5-9,12,14H,4H2,1-3H3/t9-,12-/m0/s1
InChI key: KYILFFWWKQIEEZ-CABZTGNLSA-N
SMILES: CC[C@H](C)[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC
Systematic name  (3):
  • N-[(2-ニトロフェニル)スルホニル]-L-イソロイシンメチル
  • メチル (2S,3S)-3-メチル-2-(2-ニトロベンゼンスルホンアミド)ペンタノアート
  • methyl (2S,3S)-3-methyl-2-(2-nitrobenzenesulfonamido)pentanoate
Other name (1):
  • N-[(2-Nitrophenyl)sulfonyl]-L-isoleucine methyl ester
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