Vitas-M small molecule compound
6-[(2-hydroxyethyl)amino]-2-(naphthalen-1-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294719
SMILES OCCNc1c2cccc3c2c(cc1[N+](=O)[O-])c(=O)n(c3=O)c1cccc2c1cccc2
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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 C24H17N3O5 MW 427.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17N3O5/c28-12-11-25-22-16-8-4-9-17-21(16)18(13-20(22)27(31)32)24(30)26(23(17)29)19-10-3-6-14-5-1-2-7-15(14)19/h1-10,13,25,28H,11-12H2InChIKey
ZOCAAAVXYCDJGB-UHFFFAOYSA-NSynonyms
6((2hydroxyethyl)amino)2(naphthalen1yl)5nitro1Hbenzo(de)isoquinoline13(2H)dione
6(2hydroxyethylamino)2naphthalen1yl5nitrobenzo(de)isoquinoline13dione
C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=CC=CC5=C4C(=CC(=C5NCCO)(N+)(=O)(O))C3=O
InChI=1SC24H17N3O5c2812112522168491721(16)18(1320(22)27(31)32)24(30)26(23(17)29)19103614512715(14)19h110132528H1112H2
MFCD28032765
OCCNc1c2cccc3c2c(cc1(N+)(=O)(O))c(=O)n(c3=O)c1cccc2c1cccc2
ZINC000095470801
ZINC95470801
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