Vitas-M small molecule compound

N-(2-methoxy-5-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Catalog ID
STL254547
SMILES COc1ccc(cc1NS(=O)(=O)c1ccc2c(c1)OCCO2)[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 C15H14N2O7S MW 366.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O7S/c1-22-13-4-2-10(17(18)19)8-12(13)16-25(20,21)11-3-5-14-15(9-11)24-7-6-23-14/h2-5,8-9,16H,6-7H2,1H3
InChIKey
HWBHGGDKQPEUTK-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)(N+)(=O)(O))NS(=O)(=O)C2=CC3=C(C=C2)OCCO3
COc1ccc(cc1NS(=O)(=O)c1ccc2c(c1)OCCO2)(N+)(=O)(O)
InChI=1SC15H14N2O7Sc122134210(17(18)19)812(13)1625(2021)11351415(911)24762314h258916H67H21H3
MFCD04215310
N(2methoxy5nitrophenyl)23dihydro14benzodioxine6sulfonamide
ZINC000002843039
ZINC02843039
ZINC2843039

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Available files

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