Vitas-M small molecule compound
3-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoic acid
Catalog ID
STK669477
SMILES [O-][N+](=O)c1cc2cc(cc3c2c(c1)c(=O)n(c3=O)c1cccc(c1)C(=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 C19H9N3O8 MW 407.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H9N3O8/c23-17-14-7-12(21(27)28)5-10-6-13(22(29)30)8-15(16(10)14)18(24)20(17)11-3-1-2-9(4-11)19(25)26/h1-8H,(H,25,26)InChIKey
NIPZTHWSGKAQER-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc2cc(cc3c2c(c1)c(=O)n(c3=O)c1cccc(c1)C(=O)O)(N+)(=O)(O)
3(13DIKETO58DINITROBENZO(DE)ISOQUINOLIN2YL)BENZOICACID
3(58DINITRO13BIS(OXIDANYLIDENE)BENZO(DE)ISOQUINOLIN2YL)BENZOICACID
3(58DINITRO13DIOXO1H3HBENZO(DE)ISOQUINOLIN2YL)BENZOICACID
3(58dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)benzoicacid
3(58DINITRO13DIOXO2BENZO(DE)ISOQUINOLINYL)BENZOICACID
3(58DINITRO13DIOXOBENZO(DE)ISOQUINOLIN2YL)BENZOICACID
C1=CC(=CC(=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O))C(=O)O
InChI=1SC19H9N3O8c231714712(21(27)28)510613(22(29)30)815(16(10)14)18(24)20(17)113129(411)19(25)26h18H(H2526)
MFCD00339191
ZINC000002054221
ZINC2054221
Check stock
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Check stock on Vitas-MAvailable files
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