Vitas-M small molecule compound

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

Catalog ID
STK247142
SMILES CCCCCCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)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 C26H31NO4 MW 421.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO4/c1-3-4-5-6-7-8-9-10-16-31-26(30)20-14-15-22-23(18-20)25(29)27(24(22)28)21-13-11-12-19(2)17-21/h11-15,17-18H,3-10,16H2,1-2H3
InChIKey
YPAYCEXWXRVKKV-UHFFFAOYSA-N
Synonyms

13DIOXO2MTOLYL23DIHYDRO1HISOINDOLE5CARBOXYLICACIDDECYLESTER
CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)C
DECYL2(3METHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
DECYL2(3METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
DECYL2(3METHYLPHENYL)13DIOXOISOINDOLINE5CARBOXYLATE
InChI=1SC26H31NO4c1345678910163126(30)2014152223(1820)25(29)27(24(22)28)2113111219(2)1721h11151718H31016H212H3
MFCD00596256
ZINC000002062740
ZINC02062740
ZINC2062740

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Available files

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