Vitas-M small molecule compound
4-bromo-N-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzamide
Catalog ID
STL295078
SMILES Brc1ccc(cc1)C(=O)Nn1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[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 C19H9BrN4O7 MW 485.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H9BrN4O7/c20-10-3-1-9(2-4-10)17(25)21-22-18(26)11-5-7-13(23(28)29)16-14(24(30)31)8-6-12(15(11)16)19(22)27/h1-8H,(H,21,25)InChIKey
YFPKQCMQBXSEQE-UHFFFAOYSA-NSynonyms
4bromoN(67dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)benzamide
4bromoN(67dinitro13dioxobenzo(de)isoquinolin2yl)benzamide
Brc1ccc(cc1)C(=O)Nn1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O)
C1=CC(=CC=C1C(=O)NN2C(=O)C3=C4C(=CC=C(C4=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C2=O)Br
InChI=1SC19H9BrN4O7c2010319(2410)17(25)212218(26)115713(23(28)29)1614(24(30)31)8612(15(11)16)19(22)27h18H(H2125)
MFCD28032881
ZINC000095470907
ZINC95470907
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