Vitas-M small molecule compound

butyl 2-(2,4-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK268006
SMILES CCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1C)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 C21H21NO4 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4/c1-4-5-10-26-21(25)15-7-8-16-17(12-15)20(24)22(19(16)23)18-9-6-13(2)11-14(18)3/h6-9,11-12H,4-5,10H2,1-3H3
InChIKey
ZZLDCAVNTKCEKY-UHFFFAOYSA-N
Synonyms

butyl2(24dimethylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
BUTYL2(24DIMETHYLPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
BUTYL2(24DIMETHYLPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
BUTYL2(24DIMETHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
CCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=C(C=C(C=C3)C)C
InChI=1SC21H21NO4c145102621(25)15781617(1215)20(24)22(19(16)23)189613(2)1114(18)3h691112H4510H213H3
MFCD01046534
ZINC000002062865
ZINC02062865
ZINC2062865

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Available files

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