Vitas-M small molecule compound

ethyl 4-[2-(2,4-dihydroxy-3-methylphenyl)-2-oxoethyl]piperazine-1-carboxylate

Catalog ID
STK925160
SMILES CCOC(=O)N1CCN(CC1)CC(=O)c1ccc(c(c1O)C)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 C16H22N2O5 MW 322.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O5/c1-3-23-16(22)18-8-6-17(7-9-18)10-14(20)12-4-5-13(19)11(2)15(12)21/h4-5,19,21H,3,6-10H2,1-2H3
InChIKey
GVIWAKJEPAZODG-UHFFFAOYSA-N
Synonyms
887209-45-2
6(2(4ethoxycarbonylpiperazin1ium1yl)acetyl)3hydroxy2methylphenolate
887209452
CCOC(=O)N1CC(NH+)(CC1)CC(=O)C2=C(C(=C(C=C2)O)C)(O)
ethyl4(2(24dihydroxy3methylphenyl)2oxoethyl)piperazine1carboxylate
ETHYL4(2(24DIHYDROXY3METHYLPHENYL)2OXOETHYL)PIPERAZINECARBOXYLATE
InChI=1SC16H22N2O5c132316(22)188617(7918)1014(20)124513(19)11(2)15(12)21h451921H3610H212H3
MFCD06745739
ZINC000022625840
ZINC22625840

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.