Vitas-M small molecule compound
2-(3-hydroxypropyl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL295312
SMILES OCCCn1c(=O)c2cc(cc3c2c(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 C15H12N2O5 MW 300.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5/c18-6-2-5-16-14(19)11-4-1-3-9-7-10(17(21)22)8-12(13(9)11)15(16)20/h1,3-4,7-8,18H,2,5-6H2InChIKey
HRZQYMHZXWGUCS-UHFFFAOYSA-NSynonyms
2(3hydroxypropyl)5nitro1Hbenzo(de)isoquinoline13(2H)dione
2(3HYDROXYPROPYL)5NITROBENZO(DE)ISOQUINOLINE13DIONE
C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CCCO)(N+)(=O)(O)
InChI=1SC15H12N2O5c186251614(19)114139710(17(21)22)812(13(9)11)15(16)20h1347818H256H2
MFCD00607447
OCCCn1c(=O)c2cc(cc3c2c(c1=O)ccc3)(N+)(=O)(O)
ZINC000004713024
ZINC04713024
ZINC4713024
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