Chem
J-GLOBAL ID：201707007197189174   Nikkaji number：J3.557.641J

4-(Benzyl(phenylethynyl)aminosulfonyl)benzoic acid

4-(ベンジル(フェニルエチニル)アミノスルホニル)安息香酸
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： C22H17NO4S
Molecular formula furigana： C22-H17-N-O4-S
Molecular weight： 391.440
InChI： InChI=1S/C22H17NO4S/c24-22(25)20-11-13-21(14-12-20)28(26,27)23(17-19-9-5-2-6-10-19)16-15-18-7-3-1-4-8-18/h1-14H,17H2,(H,24,25)
InChI key： YKLLHLSJDBJTPI-UHFFFAOYSA-N
SMILES： OC(=O)c1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)C#Cc1ccccc1
Systematic name  (3)：
  • 4-(ベンジル(フェニルエチニル)アミノスルホニル)安息香酸
  • 4-[ベンジル(2-フェニルエチニル)スルファモイル]安息香酸
  • 4-[benzyl(2-phenylethynyl)sulfamoyl]benzoic acid
Other name (1)：
  • 4-(Benzyl(phenylethynyl)aminosulfonyl)benzoic acid
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