Vitas-M small molecule compound
6-bromo-2-(naphthalen-1-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294754
SMILES O=c1c2cc([N+](=O)[O-])c(c3c2c(c(=O)n1c1cccc2c1cccc2)ccc3)Br
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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 C22H11BrN2O4 MW 447.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H11BrN2O4/c23-20-14-8-4-9-15-19(14)16(11-18(20)25(28)29)22(27)24(21(15)26)17-10-3-6-12-5-1-2-7-13(12)17/h1-11HInChIKey
XWKWYVKDNIZTNV-UHFFFAOYSA-NSynonyms
6bromo2(naphthalen1yl)5nitro1Hbenzo(de)isoquinoline13(2H)dione
6bromo2naphthalen1yl5nitrobenzo(de)isoquinoline13dione
C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=CC=CC5=C4C(=CC(=C5Br)(N+)(=O)(O))C3=O
InChI=1SC22H11BrN2O4c2320148491519(14)16(1118(20)25(28)29)22(27)24(21(15)26)17103612512713(12)17h111H
MFCD00607476
O=c1c2cc((N+)(=O)(O))c(c3c2c(c(=O)n1c1cccc2c1cccc2)ccc3)Br
ZINC000095470832
ZINC95470832
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