Vitas-M small molecule compound
2-(2,3-dimethylphenyl)-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL388282
SMILES [O-][N+](=O)c1cc2c(=O)n(c3cccc(c3C)C)c(=O)c3c2c(c1N1CCCCC1)ccc3
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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 C25H23N3O4 MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4/c1-15-8-6-11-20(16(15)2)27-24(29)18-10-7-9-17-22(18)19(25(27)30)14-21(28(31)32)23(17)26-12-4-3-5-13-26/h6-11,14H,3-5,12-13H2,1-2H3InChIKey
GEWMZLQQOCNGRS-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc2c(=O)n(c3cccc(c3C)C)c(=O)c3c2c(c1N1CCCCC1)ccc3
2(23DIMETHYLPHENYL)5NITRO6(1PIPERIDINYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2(23dimethylphenyl)5nitro6(piperidin1yl)1Hbenzo(de)isoquinoline13(2H)dione
2(23DIMETHYLPHENYL)5NITRO6PIPERIDIN1YLBENZO(DE)ISOQUINOLINE13DIONE
CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCCCC5)(N+)(=O)(O))C2=O)C
InChI=1SC25H23N3O4c115861120(16(15)2)2724(29)1810791722(18)19(25(27)30)1421(28(31)32)23(17)26124351326h61114H351213H212H3
MFCD03716376
ZINC000008682326
ZINC08682326
ZINC8682326
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