Vitas-M small molecule compound
(2E)-2-(acetylamino)-3-[3-chloro-5-ethoxy-4-(propan-2-yloxy)phenyl]prop-2-enoic acid
Catalog ID
STK552861
SMILES CCOc1cc(/C=C(\C(=O)O)/NC(=O)C)cc(c1OC(C)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 C16H20ClNO5 MW 341.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClNO5/c1-5-22-14-8-11(6-12(17)15(14)23-9(2)3)7-13(16(20)21)18-10(4)19/h6-9H,5H2,1-4H3,(H,18,19)(H,20,21)/b13-7+InChIKey
YIWDJBFPXGMUMK-NTUHNPAUSA-NSynonyms
799810-84-7(2E)2(acetylamino)3(3chloro5ethoxy4(propan2yloxy)phenyl)prop2enoicacid
(E)2acetamido3(3chloro5ethoxy4isopropoxyphenyl)acrylicacid
(E)2ACETAMIDO3(3CHLORO5ETHOXY4PROPAN2YLOXYPHENYL)PROP2ENOICACID
799810847
CCOC1=C(C(=CC(=C1)C=C(C(=O)O)NC(=O)C)Cl)OC(C)C
CCOc1cc(C=C(C(=O)O)NC(=O)C)cc(c1OC(C)C)Cl
InChI=1SC16H20ClNO5c152214811(612(17)15(14)239(2)3)713(16(20)21)1810(4)19h69H5H214H3(H1819)(H2021)b137+
MFCD03680539
ZINC000000554952
ZINC554952
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