Vitas-M small molecule compound
3-(4-methoxyphenoxy)-4-oxo-8-(pyrrolidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK847525
SMILES COc1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCC1)[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/c1-29-13-4-6-14(7-5-13)30-20-18(28)15-8-9-17(27)16(12-26-10-2-3-11-26)19(15)31-21(20)22(23,24)25/h4-9,27H,2-3,10-12H2,1H3InChIKey
OFEGDFLQKILYSR-UHFFFAOYSA-NSynonyms
302952-78-93(4methoxyphenoxy)4oxo8(pyrrolidin1ium1ylmethyl)2(trifluoromethyl)chromen7olate
3(4methoxyphenoxy)4oxo8(pyrrolidinium1ylmethyl)2(trifluoromethyl)4Hchromen7olate
302952789
7HYDROXY3(4METHOXYPHENOXY)8(PYRROLIDIN1YLMETHYL)2(TRIFLUOROMETHYL)4HCHROMEN4ONE
7HYDROXY3(4METHOXYPHENOXY)8(PYRROLIDIN1YLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
7HYDROXY3(4METHOXYPHENOXY)8(PYRROLIDINYLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C(NH+)4CCCC4)(O))C(F)(F)F
COc1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C(NH+)1CCCC1)(O)
InChI=1SC22H20F3NO5c129134614(7513)302018(28)158917(27)16(122610231126)19(15)3121(20)22(2324)25h4927H231012H21H3
MFCD01918602
ZINC000019789776
ZINC19789776
Check stock
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Check stock on Vitas-MAvailable files
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