Vitas-M small molecule compound

4,7-dimethyl-2-phenyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione

Catalog ID
STL387158
SMILES O=C1C2C(C(=O)N1c1ccccc1)C1(OC2(C)C=C1)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 C16H15NO3 MW 269.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO3/c1-15-8-9-16(2,20-15)12-11(15)13(18)17(14(12)19)10-6-4-3-5-7-10/h3-9,11-12H,1-2H3
InChIKey
UWPNNSUMYZJALQ-UHFFFAOYSA-N
Synonyms

47dimethyl2phenyl3a477atetrahydro1H47epoxyisoindole13(2H)dione
47dimethyl2phenyl3a7adihydrooctahydro1H47epoxyisoindole13dione
CC12C=CC(O1)(C3C2C(=O)N(C3=O)C4=CC=CC=C4)C
InChI=1SC16H15NO3c1158916(22015)1211(15)13(18)17(14(12)19)106435710h391112H12H3
MFCD00763253
NPHENYL36DIMETHYL36EPOXY4CYCLOHEXENE12DICARBIMIDE
ZINC000015223516
ZINC000101356467

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Available files

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