Vitas-M small molecule compound

2-(2,5-dimethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione

Catalog ID
STK021749
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1CCC2C=C1)OC

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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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-22-12-7-8-14(23-2)13(9-12)19-17(20)15-10-3-4-11(6-5-10)16(15)18(19)21/h3-4,7-11,15-16H,5-6H2,1-2H3
InChIKey
LUWPAVDRGWNLNI-UHFFFAOYSA-N
Synonyms

2(25DIMETHOXYPHENYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13(2H)DIONE
COC1=CC(=C(C=C1)OC)N2C(=O)C3C4CCC(C3C2=O)C=C4
COc1ccc(cc1N1C(=O)C2C(C1=O)C1CCC2C=C1)OC
InChI=1SC18H19NO4c122127814(232)13(912)1917(20)15103411(6510)16(15)18(19)21h347111516H56H212H3
MFCD02109760
STK021749
ZINC000100636390
ZINC000101860563

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Available files

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