Vitas-M small molecule compound

4-{[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl}-2-oxo-2H-chromen-6-olate

Catalog ID
STL514737
SMILES Clc1cccc(c1)N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])cc2

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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 C20H19ClN2O3 MW 370.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O3/c21-15-2-1-3-16(11-15)23-8-6-22(7-9-23)13-14-10-20(25)26-19-5-4-17(24)12-18(14)19/h1-5,10-12,24H,6-9,13H2
InChIKey
IQTBSBWVUACUIB-UHFFFAOYSA-N
Synonyms
859859-96-4
4((4(3chlorophenyl)piperazin1ium1yl)methyl)2oxo2Hchromen6olate
4((4(3chlorophenyl)piperazin1ium1yl)methyl)2oxochromen6olate
44666093
859859964
MFCD05673440
ZINC000054106029

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Available files

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