Vitas-M small molecule compound
2-(4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK033801
SMILES O=C1C2C3CCC(C2C(=O)N1c1ccc(cc1)C)C=C3
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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 C17H17NO2 MW 267.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO2/c1-10-2-8-13(9-3-10)18-16(19)14-11-4-5-12(7-6-11)15(14)17(18)20/h2-5,8-9,11-12,14-15H,6-7H2,1H3InChIKey
SHJXHBXASKLWHY-UHFFFAOYSA-NSynonyms
2(4METHYLPHENYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13(2H)DIONE
CC1=CC=C(C=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4
InChI=1SC17H17NO2c1102813(9310)1816(19)14114512(7611)15(14)17(18)20h258911121415H67H21H3
MFCD00815524
O=C1C2C3CCC(C2C(=O)N1c1ccc(cc1)C)C=C3
STK033801
ZINC000100103872
ZINC000229909855
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