Vitas-M small molecule compound
3-{[(4-chloro-3-methylphenoxy)acetyl]amino}-3-(3,4-dimethoxyphenyl)propanoic acid
Catalog ID
STK682189
SMILES COc1cc(ccc1OC)C(CC(=O)O)NC(=O)COc1ccc(c(c1)C)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 C20H22ClNO6 MW 407.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO6/c1-12-8-14(5-6-15(12)21)28-11-19(23)22-16(10-20(24)25)13-4-7-17(26-2)18(9-13)27-3/h4-9,16H,10-11H2,1-3H3,(H,22,23)(H,24,25)InChIKey
NRKHLMBSRIIOLW-UHFFFAOYSA-NSynonyms
3(((4chloro3methylphenoxy)acetyl)amino)3(34dimethoxyphenyl)propanoicacid
3((2(4CHLORO3METHYLPHENOXY)ACETYL)AMINO)3(34DIMETHOXYPHENYL)PROPANOICACID
CC1=C(C=CC(=C1)OCC(=O)NC(CC(=O)O)C2=CC(=C(C=C2)OC)OC)Cl
InChI=1SC20H22ClNO6c112814(5615(12)21)281119(23)2216(1020(24)25)134717(262)18(913)273h4916H1011H213H3(H2223)(H2425)
MFCD03821667
ZINC000003626932
ZINC000003626934
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