Vitas-M small molecule compound
2,2'-[benzene-1,3-diylbis(oxybenzene-4,1-diyl)]bis(4-nitro-1H-isoindole-1,3(2H)-dione)
Catalog ID
STK296055
SMILES O=C1c2cccc(c2C(=O)N1c1ccc(cc1)Oc1cccc(c1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cccc2[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 C34H18N4O10 MW 642.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H18N4O10/c39-31-25-6-2-8-27(37(43)44)29(25)33(41)35(31)19-10-14-21(15-11-19)47-23-4-1-5-24(18-23)48-22-16-12-20(13-17-22)36-32(40)26-7-3-9-28(38(45)46)30(26)34(36)42/h1-18HInChIKey
PXFJFAHWDYWWFY-UHFFFAOYSA-NSynonyms
22(benzene13diylbis(oxybenzene41diyl))bis(4nitro1Hisoindole13(2H)dione)
4NITRO2(4(3(4(4NITRO13DIOXOISOINDOL2YL)PHENOXY)PHENOXY)PHENYL)ISOINDOLE13DIONE
C1=CC(=CC(=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)(N+)(=O)(O))OC5=CC=C(C=C5)N6C(=O)C7=C(C6=O)C(=CC=C7)(N+)(=O)(O)
InChI=1SC34H18N4O10c39312562827(37(43)44)29(25)33(41)35(31)19101421(151119)472341524(1823)4822161220(131722)3632(40)2673928(38(45)46)30(26)34(36)42h118H
MFCD01046169
O=C1c2cccc(c2C(=O)N1c1ccc(cc1)Oc1cccc(c1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O))(N+)(=O)(O)
ZINC000150401710
ZINC150401710
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.