Chem
J-GLOBAL ID：200907077624192837   Nikkaji number：J2.548.516E

PEAQX

PEAQX
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： C17H17BrN3O5P
Molecular formula furigana： C17-H17-BR-N3-O5-P
Molecular weight： 454.217
InChI： InChI=1S/C17H17BrN3O5P/c1-9(10-5-7-11(18)8-6-10)19-17(27(24,25)26)12-3-2-4-13-14(12)21-16(23)15(22)20-13/h2-9,17,19H,1H3,(H,20,22)(H,21,23)(H2,24,25,26)/t9-,17+/m0/s1
InChI key： XXZGNAZRWCBSBK-HUTHGQBESA-N
SMILES： C[C@H](N[C@@H](c1cccc2[nH]c(=O)c(=O)[nH]c12)P(=O)(O)O)c1ccc(Br)cc1
Systematic name  (3)：
  • (R)-[[(S)-1-(4-ブロモフェニル)エチル]アミノ](1,2,3,4-テトラヒドロ-2,3-ジオキソキノキサリン-5-イル)メチルホスホン酸
  • [(R)-{[(1S)-1-(4-ブロモフェニル)エチル]アミノ}(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]ホスホン酸
  • [(R)-{[(1S)-1-(4-bromophenyl)ethyl]amino}(2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-5-yl)methyl]phosphonic acid
Other name (3)：
  • (R)-[[(S)-1-(4-Bromophenyl)ethyl]amino](1,2,3,4-tetrahydro-2,3-dioxoquinoxaline-5-yl)methylphosphonic acid
  • NVP-AAM-077
  • PEAQX
CAS registry number： 858131-65-4
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