Vitas-M small molecule compound

2-(2,5-dimethylphenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STL358282
SMILES Cc1ccc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[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 C20H14N2O4 MW 346.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O4/c1-11-6-7-12(2)17(10-11)21-19(23)14-5-3-4-13-16(22(25)26)9-8-15(18(13)14)20(21)24/h3-10H,1-2H3
InChIKey
HCQGJZNOQFWSRN-UHFFFAOYSA-N
Synonyms

2(25dimethylphenyl)6nitro1Hbenzo(de)isoquinoline13(2H)dione
2(25DIMETHYLPHENYL)6NITROBENZO(DE)ISOQUINOLINE13DIONE
CC1=CC(=C(C=C1)C)N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O
Cc1ccc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O))C
InChI=1SC20H14N2O4c1116712(2)17(1011)2119(23)145341316(22(25)26)9815(18(13)14)20(21)24h310H12H3
MFCD00476634
N(25DIMETHYLPHENYL)4NITRO18NAPHTHALENEDICARBOXIMIDE
ZINC000000459943
ZINC00459943
ZINC459943

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Available files

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