Vitas-M small molecule compound

hexyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK267905
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccccc1

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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 C21H21NO4 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4/c1-2-3-4-8-13-26-21(25)15-11-12-17-18(14-15)20(24)22(19(17)23)16-9-6-5-7-10-16/h5-7,9-12,14H,2-4,8,13H2,1H3
InChIKey
KOIANIIQKGWQCT-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3
hexyl13dioxo2phenyl23dihydro1Hisoindole5carboxylate
HEXYL13DIOXO2PHENYL5ISOINDOLINECARBOXYLATE
HEXYL13DIOXO2PHENYLBENZO(C)AZOLINE5CARBOXYLATE
HEXYL13DIOXO2PHENYLISOINDOLE5CARBOXYLATE
InChI=1SC21H21NO4c12348132621(25)1511121718(1415)20(24)22(19(17)23)1696571016h5791214H24813H21H3
MFCD01017566
ZINC000002078985
ZINC02078985
ZINC2078985

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Available files

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