Vitas-M small molecule compound

methyl N-[(4-nitrophenyl)sulfonyl]-beta-alaninate

Catalog ID
STL427204
SMILES COC(=O)CCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H12N2O6S MW 288.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N2O6S/c1-18-10(13)6-7-11-19(16,17)9-4-2-8(3-5-9)12(14)15/h2-5,11H,6-7H2,1H3
InChIKey
XAUMQBFXHCRFGM-UHFFFAOYSA-N
Synonyms
339191-82-1
339191821
COC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)(N+)(=O)(O)
COC(=O)CCNS(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC10H12N2O6Sc11810(13)671119(1617)9428(359)12(14)15h2511H67H21H3
METHYL3((4NITROPHENYL)SULFONYLAMINO)PROPANOATE
methylN((4nitrophenyl)sulfonyl)betaalaninate
MFCD00553482
ZINC000004005880
ZINC04005880
ZINC4005880

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.