Vitas-M small molecule compound

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

Catalog ID
STL049874
SMILES CCN1c2ccccc2c2n(C1c1cc(ccc1[O-])[N+](=O)[O-])c1ccccc1[nH+]2

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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 C22H18N4O3 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3/c1-2-24-18-9-5-3-7-15(18)21-23-17-8-4-6-10-19(17)25(21)22(24)16-13-14(26(28)29)11-12-20(16)27/h3-13,22,27H,2H2,1H3
InChIKey
VXZAZQDSIRDWLB-UHFFFAOYSA-N
Synonyms
846591-09-1
846591091
CCN1c2ccccc2c2n(C1c1cc(ccc1(O))(N+)(=O)(O))c1ccccc1(nH+)2
MFCD04175875
ZINC000001307205
ZINC000005197746

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Available files

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