Vitas-M small molecule compound
2-(4-butylphenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK836381
SMILES CCCCc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3[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 C22H18N2O4 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4/c1-2-3-5-14-8-10-15(11-9-14)23-21(25)17-7-4-6-16-19(24(27)28)13-12-18(20(16)17)22(23)26/h4,6-13H,2-3,5H2,1H3InChIKey
LBWJWUKIBLMWBP-UHFFFAOYSA-NSynonyms
2(4butylphenyl)6nitro1Hbenzo(de)isoquinoline13(2H)dione
2(4BUTYLPHENYL)6NITROBENZO(DE)ISOQUINOLINE13DIONE
CCCCC1=CC=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O
CCCCc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O)
InChI=1SC22H18N2O4c12351481015(11914)2321(25)177461619(24(27)28)131218(20(16)17)22(23)26h4613H235H21H3
MFCD00719253
ZINC000001818817
ZINC01818817
ZINC1818817
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