Vitas-M small molecule compound

ethyl 1-(3,4-dimethylphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK041989
SMILES CCOC(=O)C1=C(C)N(C(=O)C1)c1ccc(c(c1)C)C

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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 C16H19NO3 MW 273.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO3/c1-5-20-16(19)14-9-15(18)17(12(14)4)13-7-6-10(2)11(3)8-13/h6-8H,5,9H2,1-4H3
InChIKey
NAYHHQJUNNHXSW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C)N(C(=O)C1)c1ccc(c(c1)C)C
CCOC(=O)C1=C(N(C(=O)C1)C2=CC(=C(C=C2)C)C)C
ETHYL1(34DIMETHYLPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL1(34DIMETHYLPHENYL)5METHYL2OXO3HPYRROLE4CARBOXYLATE
InChI=1SC16H19NO3c152016(19)14915(18)17(12(14)4)137610(2)11(3)813h68H59H214H3
MFCD00815536
STK041989
ZINC000000186619
ZINC00186619
ZINC186619

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Available files

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