Vitas-M small molecule compound
3-{7-[(2-bromobenzyl)oxy]-6-chloro-4-methyl-2-oxo-2H-chromen-3-yl}propanoic acid
Catalog ID
STL226543
SMILES OC(=O)CCc1c(=O)oc2c(c1C)cc(c(c2)OCc1ccccc1Br)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 C20H16BrClO5 MW 451.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClO5/c1-11-13(6-7-19(23)24)20(25)27-17-9-18(16(22)8-14(11)17)26-10-12-4-2-3-5-15(12)21/h2-5,8-9H,6-7,10H2,1H3,(H,23,24)InChIKey
LCRKCCIXZLXLHS-UHFFFAOYSA-NSynonyms
848990-37-43(7((2bromobenzyl)oxy)6chloro4methyl2oxo2Hchromen3yl)propanoicacid
3(7((2BROMOPHENYL)METHOXY)6CHLORO4METHYL2OXOCHROMEN3YL)PROPANOICACID
848990374
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=CC=C3Br)CCC(=O)O
InChI=1SC20H16BrClO5c11113(6719(23)24)20(25)2717918(16(22)814(11)17)261012423515(12)21h2589H6710H21H3(H2324)
MFCD05678940
ZINC000002446715
ZINC2446715
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