Vitas-M small molecule compound
4-nitro-2-(9H-xanthen-9-yl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK388007
SMILES O=C1c2cccc(c2C(=O)N1C1c2ccccc2Oc2c1cccc2)[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 C21H12N2O5 MW 372.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N2O5/c24-20-14-8-5-9-15(23(26)27)18(14)21(25)22(20)19-12-6-1-3-10-16(12)28-17-11-4-2-7-13(17)19/h1-11,19HInChIKey
WPXYVCSUJHULNH-UHFFFAOYSA-NSynonyms
4NITRO2(9HXANTHEN9YL)1HISOINDOLE13(2H)DIONE
4NITRO2(9HXANTHEN9YL)ISOINDOLE13DIONE
4nitro2(9Hxanthen9yl)isoindoline13dione
4NITRO2XANTHEN9YLBENZO(C)AZOLINE13DIONE
C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)N4C(=O)C5=C(C4=O)C(=CC=C5)(N+)(=O)(O)
InChI=1SC21H12N2O5c24201485915(23(26)27)18(14)21(25)22(20)19126131016(12)28171142713(17)19h11119H
MFCD00349599
O=C1c2cccc(c2C(=O)N1C1c2ccccc2Oc2c1cccc2)(N+)(=O)(O)
ZINC000001100047
ZINC01100047
ZINC1100047
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