Vitas-M small molecule compound

8-methyl-2-oxo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-7-olate

Catalog ID
STL515119
SMILES O=c1cc(C[NH+]2CCN(CC2)c2ccccc2)c2c(o1)c(C)c(cc2)[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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-15-19(24)8-7-18-16(13-20(25)26-21(15)18)14-22-9-11-23(12-10-22)17-5-3-2-4-6-17/h2-8,13,24H,9-12,14H2,1H3
InChIKey
FEVRQHLCYZNKSS-UHFFFAOYSA-N
Synonyms
849536-29-4
44664061
849536294
8methyl2oxo4((4phenylpiperazin1ium1yl)methyl)2Hchromen7olate
8methyl2oxo4((4phenylpiperazin1ium1yl)methyl)chromen7olate
MFCD05676652
ZINC000054105927

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Available files

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