Vitas-M small molecule compound

N,N'-bis(2-methoxyethyl)-4,5-dinitro-9-oxo-9H-fluorene-2,7-disulfonamide

Catalog ID
STK545110
SMILES COCCNS(=O)(=O)c1cc2C(=O)c3c(c2c(c1)[N+](=O)[O-])c(cc(c3)S(=O)(=O)NCCOC)[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 C19H20N4O11S2 MW 544.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O11S2/c1-33-5-3-20-35(29,30)11-7-13-17(15(9-11)22(25)26)18-14(19(13)24)8-12(10-16(18)23(27)28)36(31,32)21-4-6-34-2/h7-10,20-21H,3-6H2,1-2H3
InChIKey
LFFFJXKSXCLFLR-UHFFFAOYSA-N
Synonyms
327061-08-5
2N7NBIS(2METHOXYETHYL)45DINITRO9OXOFLUORENE27DISULFONAMIDE
327061085
COCCNS(=O)(=O)C1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C32)(N+)(=O)(O))S(=O)(=O)NCCOC)(N+)(=O)(O)
COCCNS(=O)(=O)c1cc2C(=O)c3c(c2c(c1)(N+)(=O)(O))c(cc(c3)S(=O)(=O)NCCOC)(N+)(=O)(O)
InChI=1SC19H20N4O11S2c133532035(2930)1171317(15(911)22(25)26)1814(19(13)24)812(1016(18)23(27)28)36(3132)2146342h7102021H36H212H3
MFCD03299882
N2N7bis(2methoxyethyl)45dinitro9oxo9Hfluorene27disulfonamide
NNbis(2methoxyethyl)45dinitro9oxo9Hfluorene27disulfonamide
ZINC000100884020
ZINC100884020

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Available files

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