Vitas-M small molecule compound
2-(4-methoxy-2-nitrophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL295080
SMILES COc1ccc(c(c1)[N+](=O)[O-])n1c(=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 C19H10N4O9 MW 438.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H10N4O9/c1-32-9-2-5-12(15(8-9)23(30)31)20-18(24)10-3-6-13(21(26)27)17-14(22(28)29)7-4-11(16(10)17)19(20)25/h2-8H,1H3InChIKey
GHMNABZJSXEAMZ-UHFFFAOYSA-NSynonyms
2(4methoxy2nitrophenyl)67dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(4methoxy2nitrophenyl)67dinitrobenzo(de)isoquinoline13dione
COC1=CC(=C(C=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C2=O)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))n1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H10N4O9c13292512(15(89)23(30)31)2018(24)103613(21(26)27)1714(22(28)29)7411(16(10)17)19(20)25h28H1H3
MFCD00659970
ZINC000101141613
ZINC101141613
Check stock
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