Vitas-M small molecule compound

2-(2-methoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK274556
SMILES COc1ccccc1N1C(=O)C2C(C1=O)C1CC2C=C1

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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 C16H15NO3 MW 269.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO3/c1-20-12-5-3-2-4-11(12)17-15(18)13-9-6-7-10(8-9)14(13)16(17)19/h2-7,9-10,13-14H,8H2,1H3
InChIKey
XRULRZXSODUQHB-UHFFFAOYSA-N
Synonyms

(3AR4R7S7AS)2(2METHOXYPHENYL)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
2(2METHOXYPHENYL)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
COC1=CC=CC=C1N2C(=O)C3C4CC(C3C2=O)C=C4
InChI=1SC16H15NO3c12012532411(12)1715(18)1396710(89)14(13)16(17)19h279101314H8H21H3
MFCD00423320
ZINC000100382368
ZINC000100706054

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Available files

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