Chem
J-GLOBAL ID：200907006652884324   Nikkaji number：J1.235.174G

[(1S)-1-(2,3-Dioxo-7-bromo-1,2,3,4-tetrahydroquinoxaline-5-ylmethylamino)ethyl]phosphonic acid

[(1S)-1-(2,3-ジオキソ-7-ブロモ-1,2,3,4-テトラヒドロキノキサリン-5-イルメチルアミノ)エチル]ホスホン酸
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： C11H13BrN3O5P
Molecular formula furigana： C11-H13-BR-N3-O5-P
Molecular weight： 378.119
InChI： InChI=1S/C11H13BrN3O5P/c1-5(21(18,19)20)13-4-6-2-7(12)3-8-9(6)15-11(17)10(16)14-8/h2-3,5,13H,4H2,1H3,(H,14,16)(H,15,17)(H2,18,19,20)/t5-/m0/s1
InChI key： DPFHVUSPVHRVFL-YFKPBYRVSA-N
SMILES： C[C@@H](NCc1cc(Br)cc2[nH]c(=O)c(=O)[nH]c12)P(=O)(O)O
Systematic name  (3)：
  • [(1S)-1-(2,3-ジオキソ-7-ブロモ-1,2,3,4-テトラヒドロキノキサリン-5-イルメチルアミノ)エチル]ホスホン酸
  • [(1S)-1-{[(7-ブロモ-2,3-ジオキソ-1,2,3,4-テトラヒドロキノキサリン-5-イル)メチル]アミノ}エチル]ホスホン酸
  • [(1S)-1-{[(7-bromo-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-5-yl)methyl]amino}ethyl]phosphonic acid
Other name (1)：
  • [(1S)-1-(2,3-Dioxo-7-bromo-1,2,3,4-tetrahydroquinoxaline-5-ylmethylamino)ethyl]phosphonic acid
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