Vitas-M small molecule compound
3-(2-methoxyphenyl)-8-(morpholin-4-ium-4-ylmethyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK582890
SMILES COc1ccccc1c1c(=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 C22H20F3NO5 MW 435.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3NO5/c1-29-17-5-3-2-4-13(17)18-19(28)14-6-7-16(27)15(12-26-8-10-30-11-9-26)20(14)31-21(18)22(23,24)25/h2-7,27H,8-12H2,1H3InChIKey
GGENEVBNUNSZFW-UHFFFAOYSA-NSynonyms
303119-42-83(2methoxyphenyl)8(morpholin4ium4ylmethyl)4oxo2(trifluoromethyl)4Hchromen7olate
3(2methoxyphenyl)8(morpholin4ium4ylmethyl)4oxo2(trifluoromethyl)chromen7olate
303119428
7HYDROXY3(2METHOXYPHENYL)8(MORPHOLIN4YLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
COC1=CC=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3C(NH+)4CCOCC4)(O))C(F)(F)F
COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)1CCOCC1)(O)
InChI=1SC22H20F3NO5c12917532413(17)1819(28)146716(27)15(12268103011926)20(14)3121(18)22(2324)25h2727H812H21H3
MFCD02081740
ZINC000019790364
ZINC19790364
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