Vitas-M small molecule compound

2,2'-benzene-1,3-diylbis[5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione]

Catalog ID
STK024996
SMILES O=C1c2cc(ccc2C(=O)N1c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)[N+](=O)[O-])Oc1cccc(c1)[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/c39-31-27-12-10-25(47-23-8-2-6-21(15-23)37(43)44)17-29(27)33(41)35(31)19-4-1-5-20(14-19)36-32(40)28-13-11-26(18-30(28)34(36)42)48-24-9-3-7-22(16-24)38(45)46/h1-18H
InChIKey
QVTBZRRTIBCVGB-UHFFFAOYSA-N
Synonyms

22BENZENE13DIYLBIS(5(3NITROPHENOXY)1HISOINDOLE13(2H)DIONE)
5(3NITROPHENOXY)2(3(5(3NITROPHENOXY)13DIOXOISOINDOL2YL)PHENYL)ISOINDOLE13DIONE
C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)(N+)(=O)(O))N5C(=O)C6=C(C5=O)C=C(C=C6)OC7=CC=CC(=C7)(N+)(=O)(O)
InChI=1SC34H18N4O10c393127121025(472382621(1523)37(43)44)1729(27)33(41)35(31)1941520(1419)3632(40)28131126(1830(28)34(36)42)482493722(1624)38(45)46h118H
MFCD00304563
O=C1c2cc(ccc2C(=O)N1c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O))Oc1cccc(c1)(N+)(=O)(O)
STK024996
ZINC000150415772
ZINC150415772

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Available files

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