Vitas-M small molecule compound
2-(3-hydroxy-4-nitrobutyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK374478
SMILES OC(C[N+](=O)[O-])CCN1C(=O)c2c(C1=O)cccc2
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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 C12H12N2O5 MW 264.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O5/c15-8(7-14(18)19)5-6-13-11(16)9-3-1-2-4-10(9)12(13)17/h1-4,8,15H,5-7H2InChIKey
PJUVZZCSBFTSAT-UHFFFAOYSA-NSynonyms
2(3hydroxy4nitrobutyl)1Hisoindole13(2H)dione
2(3HYDROXY4NITROBUTYL)BENZO(C)AZOLINE13DIONE
2(3HYDROXY4NITROBUTYL)ISOINDOLE13DIONE
C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(C(N+)(=O)(O))O
InChI=1SC12H12N2O5c158(714(18)19)561311(16)9312410(9)12(13)17h14815H57H2
MFCD01191715
OC(C(N+)(=O)(O))CCN1C(=O)c2c(C1=O)cccc2
ZINC000000477277
ZINC000000477278
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