Vitas-M small molecule compound

decyl 2-(4-ethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247248
SMILES CCCCCCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)OCC

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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 C27H33NO5 MW 451.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO5/c1-3-5-6-7-8-9-10-11-18-33-27(31)20-12-17-23-24(19-20)26(30)28(25(23)29)21-13-15-22(16-14-21)32-4-2/h12-17,19H,3-11,18H2,1-2H3
InChIKey
YLCBWSTYPXLNQV-UHFFFAOYSA-N
Synonyms

CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OCC
DECYL2(4ETHOXYPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
DECYL2(4ETHOXYPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
DECYL2(4ETHOXYPHENYL)13DIOXOISOINDOLINE5CARBOXYLATE
InChI=1SC27H33NO5c13567891011183327(31)2012172324(1920)26(30)28(25(23)29)21131522(161421)3242h121719H31118H212H3
MFCD01062773
ZINC000008449013
ZINC08449013
ZINC8449013

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Available files

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