Vitas-M small molecule compound

methyl (4Z)-4-(3-hydroxybenzylidene)-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK165129
SMILES COCCN1C(=O)/C(=C\c2cccc(c2)O)/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 C17H19NO5 MW 317.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5/c1-11-15(17(21)23-3)14(16(20)18(11)7-8-22-2)10-12-5-4-6-13(19)9-12/h4-6,9-10,19H,7-8H2,1-3H3/b14-10-
InChIKey
YRQMRCAEKPCOHP-UVTDQMKNSA-N
Synonyms

CC1=C(C(=CC2=CC(=CC=C2)O)C(=O)N1CCOC)C(=O)OC
COCCN1C(=O)C(=Cc2cccc(c2)O)C(=C1C)C(=O)OC
InChI=1SC17H19NO5c11115(17(21)233)14(16(20)18(11)78222)101254613(19)912h4691019H78H213H3b1410
METHYL(4Z)4((3HYDROXYPHENYL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)4(3HYDROXYBENZYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01121725
ZINC000004702333
ZINC04702333
ZINC4702333

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Available files

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