Vitas-M small molecule compound
2-(3-hydroxyphenyl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL295150
SMILES Oc1cccc(c1)n1c(=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 C18H10N2O5 MW 334.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10N2O5/c21-13-5-2-4-11(8-13)19-17(22)14-6-1-3-10-7-12(20(24)25)9-15(16(10)14)18(19)23/h1-9,21HInChIKey
PTQJTJQVBUZFJG-UHFFFAOYSA-NSynonyms
2(3hydroxyphenyl)5nitro1Hbenzo(de)isoquinoline13(2H)dione
2(3HYDROXYPHENYL)5NITROBENZO(DE)ISOQUINOLINE13DIONE
C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)C4=CC(=CC=C4)O)(N+)(=O)(O)
InChI=1SC18H10N2O5c211352411(813)1917(22)1461310712(20(24)25)915(16(10)14)18(19)23h1921H
MFCD00607427
Oc1cccc(c1)n1c(=O)c2cc(cc3c2c(c1=O)ccc3)(N+)(=O)(O)
ZINC000000344988
ZINC00344988
ZINC344988
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