Vitas-M small molecule compound

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

Catalog ID
STL406243
SMILES COC(=O)C1=C(C)N(CC1=O)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 C15H17NO3 MW 259.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO3/c1-9-5-6-12(7-10(9)2)16-8-13(17)14(11(16)3)15(18)19-4/h5-7H,8H2,1-4H3
InChIKey
ZCLNJLULNMBLTP-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)N2CC(=O)C(=C2C)C(=O)OC)C
InChI=1SC15H17NO3c195612(710(9)2)16813(17)14(11(16)3)15(18)194h57H8H214H3
methyl1(34dimethylphenyl)2methyl4oxo45dihydro1Hpyrrole3carboxylate
methyl1(34dimethylphenyl)5methyl3oxo2Hpyrrole4carboxylate
MFCD30704437
ZINC000223208685
ZINC223208685

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Available files

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