Vitas-M small molecule compound
3-(4-chlorophenyl)-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-oxo-4H-chromen-7-olate
Catalog ID
STK568312
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Cl
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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 C22H23ClN2O4 MW 414.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O4/c23-16-3-1-15(2-4-16)19-14-29-22-17(21(19)28)5-6-20(27)18(22)13-25-9-7-24(8-10-25)11-12-26/h1-6,14,26-27H,7-13H2InChIKey
FYQSUVUWJCYYDI-UHFFFAOYSA-NSynonyms
846580-79-83(4CHLOROPHENYL)7HYDROXY8((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)CHROMEN4ONE
3(4CHLOROPHENYL)7HYDROXY8((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)CHROMEN4ONE
3(4chlorophenyl)8((4(2hydroxyethyl)piperazin1ium1yl)methyl)4oxo4Hchromen7olate
3(4CHLOROPHENYL)8((4(2HYDROXYETHYL)PIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
C1CN(CC(NH+)1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=C(C=C4)Cl)(O))CCO
InChI=1SC22H23ClN2O4c23163115(2416)1914292217(21(19)28)5620(27)18(22)13259724(81025)111226h16142627H713H2
MFCD04175220
OCCN1CC(NH+)(CC1)Cc1c((O))ccc2c1occ(c2=O)c1ccc(cc1)Cl
ZINC000020392990
ZINC20392990
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