Vitas-M small molecule compound

2-(5,6-dihydrobenzimidazo[1,2-c]quinazolin-12-ium-6-yl)-4-nitrophenolate

Catalog ID
STK570625
SMILES [O-]c1ccc(cc1C1Nc2ccccc2c2n1c1ccccc1[nH+]2)[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 C20H14N4O3 MW 358.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O3/c25-18-10-9-12(24(26)27)11-14(18)20-21-15-6-2-1-5-13(15)19-22-16-7-3-4-8-17(16)23(19)20/h1-11,20-21,25H
InChIKey
WZQOEGSHGIETJO-UHFFFAOYSA-N
Synonyms
848206-14-4
(O)c1ccc(cc1C1Nc2ccccc2c2n1c1ccccc1(nH+)2)(N+)(=O)(O)
2(56dihydrobenzimidazo(12c)quinazolin12ium6yl)4nitrophenolate
848206144
MFCD04188105
ZINC000001316234
ZINC000001316235

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.