Vitas-M small molecule compound

3-(4-chlorophenyl)-8-(morpholin-4-ium-4-ylmethyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate

Catalog ID
STL055361
SMILES Clc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCOCC1)[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 C21H17ClF3NO4 MW 439.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3NO4/c22-13-3-1-12(2-4-13)17-18(28)14-5-6-16(27)15(11-26-7-9-29-10-8-26)19(14)30-20(17)21(23,24)25/h1-6,27H,7-11H2
InChIKey
LDOTWLNPIAORCR-UHFFFAOYSA-N
Synonyms
307507-07-9
3(4chlorophenyl)8(morpholin4ium4ylmethyl)4oxo2(trifluoromethyl)4Hchromen7olate
Clc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)1CCOCC1)(O)

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Available files

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