Vitas-M small molecule compound

ethyl (4-{[3-(1,3-benzodioxol-5-yl)-3-oxopropyl]amino}phenyl)acetate

Catalog ID
STK784461
SMILES CCOC(=O)Cc1ccc(cc1)NCCC(=O)c1ccc2c(c1)OCO2

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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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-2-24-20(23)11-14-3-6-16(7-4-14)21-10-9-17(22)15-5-8-18-19(12-15)26-13-25-18/h3-8,12,21H,2,9-11,13H2,1H3
InChIKey
ZHGRCJXQOMCQNU-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC1=CC=C(C=C1)NCCC(=O)C2=CC3=C(C=C2)OCO3
ethyl(4((3(13benzodioxol5yl)3oxopropyl)amino)phenyl)acetate
ETHYL2(4((3(13BENZODIOXOL5YL)3OXOPROPYL)AMINO)PHENYL)ACETATE
InChI=1SC20H21NO5c122420(23)11143616(7414)2110917(22)15581819(1215)26132518h381221H291113H21H3
MFCD07022324
ZINC000004709007
ZINC04709007
ZINC4709007

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Available files

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