Vitas-M small molecule compound
2-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propanoic acid
Catalog ID
STL383115
SMILES OC(=O)C(n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[N+](=O)[O-])[N+](=O)[O-])C
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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 C15H9N3O8 MW 359.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9N3O8/c1-6(15(21)22)16-13(19)10-4-8(17(23)24)2-7-3-9(18(25)26)5-11(12(7)10)14(16)20/h2-6H,1H3,(H,21,22)InChIKey
ZOJJLYPUPRRRRG-UHFFFAOYSA-NSynonyms
2(58dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)propanoicacid
2(58DINITRO13DIOXOBENZO(DE)ISOQUINOLIN2YL)PROPANOICACID
CC(C(=O)O)N1C(=O)C2=CC(=CC3=CC(=CC(=C32)C1=O)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC15H9N3O8c16(15(21)22)1613(19)1048(17(23)24)2739(18(25)26)511(12(7)10)14(16)20h26H1H3(H2122)
MFCD00371295
OC(=O)C(n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)(N+)(=O)(O))(N+)(=O)(O))C
ZINC000016322432
ZINC000016322434
Check stock
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Check stock on Vitas-MAvailable files
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