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Substance Name: 2-(4-(((3-Carboxymethoxybenzyl)-N-((pyridin-3-yl)sulfonyl)amino)methyl)phenyl)-2-methylpropionic acid
RN: 574759-31-2
UNII: QX28NXX8UG
InChIKey: JOJLHDZTZBZWSZ-UHFFFAOYSA-N

Molecular Formula

  • C25-H26-N2-O7-S

Molecular Weight

  • 498.5481
 
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Names and Synonyms

Name of Substance

  • 2-(4-(((3-Carboxymethoxybenzyl)-N-((pyridin-3-yl)sulfonyl)amino)methyl)phenyl)-2-methylpropionic acid

Synonyms

  • 2-(4-(((3-Carboxymethoxybenzyl)-N-((pyridin-3-yl)sulfonyl)amino)methyl)phenyl)-2-methylpropionic acid
  • 4-((((3-(Carboxymethoxy)phenyl)methyl)(3-pyridinylsulfonyl)amino)methyl)-alpha,alpha-dimethylbenzeneacetic acid
  • Benzeneacetic acid, 4-((((3-(carboxymethoxy)phenyl)methyl)(3-pyridinylsulfonyl)amino)methyl)-alpha,alpha-dimethyl-
  • CP-533,536 metabolite M3
  • UNII-QX28NXX8UG

Registry Numbers

CAS Registry Number

  • 574759-31-2

FDA UNII

  • QX28NXX8UG

System Generated Number

  • 0574759312

Structure Descriptors

InChI

1S/C25H26N2O7S/c1-25(2,24(30)31)20-10-8-18(9-11-20)15-27(35(32,33)22-7-4-12-26-14-22)16-19-5-3-6-21(13-19)34-17-23(28)29/h3-14H,15-17H2,1-2H3,(H,28,29)(H,30,31)

InChIKey

JOJLHDZTZBZWSZ-UHFFFAOYSA-N

Smiles

CC(C)(C(=O)O)c1ccc(CN(Cc2cccc(OCC(=O)O)c2)S(=O)(=O)c3cccnc3)cc1