Vitas-M small molecule compound

ethyl 1,2-dimethyl-5-{[(4-methylphenyl)carbonyl]oxy}-1H-indole-3-carboxylate

Catalog ID
STK744805
SMILES CCOC(=O)c1c(C)n(c2c1cc(cc2)OC(=O)c1ccc(cc1)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 C21H21NO4 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4/c1-5-25-21(24)19-14(3)22(4)18-11-10-16(12-17(18)19)26-20(23)15-8-6-13(2)7-9-15/h6-12H,5H2,1-4H3
InChIKey
QBDXKZHQPMQMQT-UHFFFAOYSA-N
Synonyms
309737-67-5
12DIMETHYL5(4METHYLBENZOYLOXY)1HINDOLE3CARBOXYLICACIDETHYLESTER
3(ETHOXYCARBONYL)12DIMETHYLINDOL5YL4METHYLBENZOATE
309737675
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)C)C)C
ethyl12dimethyl5(((4methylphenyl)carbonyl)oxy)1Hindole3carboxylate
ethyl12dimethyl5((4methylbenzoyl)oxy)1Hindole3carboxylate
ETHYL12DIMETHYL5(4METHYLBENZOYL)OXYINDOLE3CARBOXYLATE
InChI=1SC21H21NO4c152521(24)1914(3)22(4)18111016(1217(18)19)2620(23)158613(2)7915h612H5H214H3
MFCD01238663
ZINC000000843674
ZINC00843674
ZINC843674

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Available files

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