Vitas-M small molecule compound

hexyl 1,3-dioxo-2-(4-phenoxyphenyl)-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK269681
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Oc1ccccc1

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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 C27H25NO5 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO5/c1-2-3-4-8-17-32-27(31)19-11-16-23-24(18-19)26(30)28(25(23)29)20-12-14-22(15-13-20)33-21-9-6-5-7-10-21/h5-7,9-16,18H,2-4,8,17H2,1H3
InChIKey
NXTGLGAQVZVNIT-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4
hexyl13dioxo2(4phenoxyphenyl)23dihydro1Hisoindole5carboxylate
HEXYL13DIOXO2(4PHENOXYPHENYL)5ISOINDOLINECARBOXYLATE
HEXYL13DIOXO2(4PHENOXYPHENYL)BENZO(C)AZOLIDINE5CARBOXYLATE
HEXYL13DIOXO2(4PHENOXYPHENYL)ISOINDOLE5CARBOXYLATE
InChI=1SC27H25NO5c12348173227(31)1911162324(1819)26(30)28(25(23)29)20121422(151320)332196571021h5791618H24817H21H3
MFCD02822584
ZINC000002079092
ZINC02079092
ZINC2079092

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Available files

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