Vitas-M small molecule compound
methyl (4Z)-1-ethyl-4-(2-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK804852
SMILES CCN1C(=O)/C(=C\c2ccccc2O)/C(=C1C)C(=O)OC
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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 C16H17NO4 MW 287.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4/c1-4-17-10(2)14(16(20)21-3)12(15(17)19)9-11-7-5-6-8-13(11)18/h5-9,18H,4H2,1-3H3/b12-9-InChIKey
LUQUOMMDBFGELF-XFXZXTDPSA-NSynonyms
(Z)methyl1ethyl4(2hydroxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CCN1C(=C(C(=CC2=CC=CC=C2O)C1=O)C(=O)OC)C
CCN1C(=O)C(=Cc2ccccc2O)C(=C1C)C(=O)OC
InChI=1SC16H17NO4c141710(2)14(16(20)213)12(15(17)19)911756813(11)18h5918H4H213H3b129
METHYL(4Z)1ETHYL4((2HYDROXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
methyl(4Z)1ethyl4(2hydroxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
MFCD01893986
ZINC000000113039
ZINC00113039
ZINC113039
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