Vitas-M small molecule compound

2,2'-(oxydibenzene-4,1-diyl)bis(5-nitro-1H-isoindole-1,3(2H)-dione)

Catalog ID
STK296341
SMILES O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])[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 C28H14N4O9 MW 550.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H14N4O9/c33-25-21-11-5-17(31(37)38)13-23(21)27(35)29(25)15-1-7-19(8-2-15)41-20-9-3-16(4-10-20)30-26(34)22-12-6-18(32(39)40)14-24(22)28(30)36/h1-14H
InChIKey
CUVKARXXSQMGRZ-UHFFFAOYSA-N
Synonyms
53055-74-6
1HISOINDOLE13(2H)DIONE22(OXYDI41PHENYLENE)BIS(5NITRO
22(oxydibenzene41diyl)bis(5nitro1Hisoindole13(2H)dione)
53055746
5NITRO2(4(4(5NITRO13DIOXOBENZO(C)AZOLIN2YL)PHENOXY)PHENYL)BENZO(C)AZOLINE13DIONE
5NITRO2(4(4(5NITRO13DIOXOISOINDOL2YL)PHENOXY)PHENYL)ISOINDOLE13DIONE
C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O))OC4=CC=C(C=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)(N+)(=O)(O)
InChI=1SC28H14N4O9c33252111517(31(37)38)1323(21)27(35)29(25)151719(8215)41209316(41020)3026(34)2212618(32(39)40)1424(22)28(30)36h114H
MFCD00305965
O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O))(N+)(=O)(O)
ZINC000002924844
ZINC2924844

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Available files

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