Vitas-M small molecule compound

ethyl 3-(2-methoxybenzyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK405725
SMILES CCOC(=O)c1[nH]c2c(c1Cc1ccccc1OC)C(=O)CC(C2)(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 C21H25NO4 MW 355.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4/c1-5-26-20(24)19-14(10-13-8-6-7-9-17(13)25-4)18-15(22-19)11-21(2,3)12-16(18)23/h6-9,22H,5,10-12H2,1-4H3
InChIKey
LQUVWFZHTJYIQV-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c2c(c1Cc1ccccc1OC)C(=O)CC(C2)(C)C
CCOC(=O)C1=C(C2=C(N1)CC(CC2=O)(C)C)CC3=CC=CC=C3OC
ETHYL3((2METHOXYPHENYL)METHYL)66DIMETHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
ethyl3((2methoxyphenyl)methyl)66dimethyl4oxo57dihydro1Hindole2carboxylate
ethyl3(2methoxybenzyl)66dimethyl4oxo4567tetrahydro1Hindole2carboxylate
InChI=1SC21H25NO4c152620(24)1914(1013867917(13)254)1815(2219)1121(23)1216(18)23h6922H51012H214H3
MFCD06754318
ZINC000004911834
ZINC04911834
ZINC4911834

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Available files

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