Vitas-M small molecule compound
2-(4-hydroxyphenyl)-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK096320
SMILES Oc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)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 C20H12N2O6 MW 376.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O6/c23-14-6-4-12(5-7-14)21-19(24)17-9-8-16(11-18(17)20(21)25)28-15-3-1-2-13(10-15)22(26)27/h1-11,23HInChIKey
NEJLUUAJKDBJIU-UHFFFAOYSA-NSynonyms
2(4HYDROXYPHENYL)5(3NITROPHENOXY)1HISOINDOLE13(2H)DIONE
2(4HYDROXYPHENYL)5(3NITROPHENOXY)ISOINDOLE13DIONE
C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)O)(N+)(=O)(O)
InChI=1SC20H12N2O6c23146412(5714)2119(24)179816(1118(17)20(21)25)281531213(1015)22(26)27h11123H
MFCD00349559
Oc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)Oc1cccc(c1)(N+)(=O)(O)
STK096320
ZINC000000793763
ZINC00793763
ZINC793763
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