Vitas-M small molecule compound
3-{[(3-bromo-4-methoxyphenyl)carbonyl]amino}-3-(4-ethoxy-3-methoxyphenyl)propanoic acid
Catalog ID
STK679956
SMILES CCOc1ccc(cc1OC)C(NC(=O)c1ccc(c(c1)Br)OC)CC(=O)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 C20H22BrNO6 MW 452.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO6/c1-4-28-17-8-5-12(10-18(17)27-3)15(11-19(23)24)22-20(25)13-6-7-16(26-2)14(21)9-13/h5-10,15H,4,11H2,1-3H3,(H,22,25)(H,23,24)InChIKey
CKJCIQBSKQEUPI-UHFFFAOYSA-NSynonyms
3(((3bromo4methoxyphenyl)carbonyl)amino)3(4ethoxy3methoxyphenyl)propanoicacid
3((3BROMO4METHOXYBENZOYL)AMINO)3(4ETHOXY3METHOXYPHENYL)PROPANOICACID
CCOC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=C(C=C2)OC)Br)OC
InChI=1SC20H22BrNO6c1428178512(1018(17)273)15(1119(23)24)2220(25)136716(262)14(21)913h51015H411H213H3(H2225)(H2324)
MFCD03766531
ZINC000008868845
ZINC000008868847
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