Vitas-M small molecule compound
2-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propanoic acid
Catalog ID
STL383116
SMILES OC(=O)C(n1c(=O)c2ccc(c3c2c(c1=O)ccc3[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)7-2-4-9(17(23)24)12-10(18(25)26)5-3-8(11(7)12)14(16)20/h2-6H,1H3,(H,21,22)InChIKey
IADJUXFIFVUQSC-UHFFFAOYSA-NSynonyms
2(67dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)propanoicacid
2(67dinitro13dioxobenzo(de)isoquinolin2yl)propanoicacid
CC(C(=O)O)N1C(=O)C2=C3C(=CC=C(C3=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))C1=O
InChI=1SC15H9N3O8c16(15(21)22)1613(19)7249(17(23)24)1210(18(25)26)538(11(7)12)14(16)20h26H1H3(H2122)
MFCD00371294
OC(=O)C(n1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O))C
ZINC000098087106
ZINC000098087107
Check stock
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