Vitas-M small molecule compound
2-(2-methoxyphenyl)-6-(morpholin-4-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL358600
SMILES COc1ccccc1n1c(=O)c2cc([N+](=O)[O-])c(c3c2c(c1=O)ccc3)N1CCOCC1
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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 C23H19N3O6 MW 433.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6/c1-31-19-8-3-2-7-17(19)25-22(27)15-6-4-5-14-20(15)16(23(25)28)13-18(26(29)30)21(14)24-9-11-32-12-10-24/h2-8,13H,9-12H2,1H3InChIKey
AIXYDTGOLNGWOP-UHFFFAOYSA-NSynonyms
2(2METHOXYPHENYL)6(4MORPHOLINYL)5NITRO1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2(2methoxyphenyl)6(morpholin4yl)5nitro1Hbenzo(de)isoquinoline13(2H)dione
2(2METHOXYPHENYL)6MORPHOLIN4YL5NITROBENZO(DE)ISOQUINOLINE13DIONE
COC1=CC=CC=C1N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCOCC5)(N+)(=O)(O))C2=O
COc1ccccc1n1c(=O)c2cc((N+)(=O)(O))c(c3c2c(c1=O)ccc3)N1CCOCC1
InChI=1SC23H19N3O6c13119832717(19)2522(27)156451420(15)16(23(25)28)1318(26(29)30)21(14)2491132121024h2813H912H21H3
MFCD03993207
ZINC000013153646
ZINC13153646
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