Vitas-M small molecule compound

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

Catalog ID
STK281023
SMILES CC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CCC2C=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 C18H17NO3 MW 295.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO3/c1-10(20)11-6-8-14(9-7-11)19-17(21)15-12-2-3-13(5-4-12)16(15)18(19)22/h2-3,6-9,12-13,15-16H,4-5H2,1H3
InChIKey
FHFDNSMSVKYGND-UHFFFAOYSA-N
Synonyms
354808-10-9
2(4acetylphenyl)3a477atetrahydro1H47ethanoisoindole13(2H)dione
2(4ACETYLPHENYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13DIONE
354808109
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4
InChI=1SC18H17NO3c110(20)116814(9711)1917(21)15122313(5412)16(15)18(19)22h236912131516H45H21H3
MFCD02084444
ZINC000100201199
ZINC000100842536

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Available files

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