Vitas-M small molecule compound

2-phenyltetrahydro-1H-4,7-ethanoisoindole-1,3,5,8(2H,4H)-tetrone

Catalog ID
STK542621
SMILES O=C1C2C(C(=O)N1c1ccccc1)C1CC(=O)C2CC1=O

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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 C16H13NO4 MW 283.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO4/c18-11-6-9-12(19)7-10(11)14-13(9)15(20)17(16(14)21)8-4-2-1-3-5-8/h1-5,9-10,13-14H,6-7H2
InChIKey
FYBYTIAYCLNTRP-UHFFFAOYSA-N
Synonyms
459153-22-1
(3aR4R7R7aS)2phenyltetrahydro1H47ethanoisoindole1358(2H6H)tetraone
2phenyltetrahydro1H47ethanoisoindole1358(2H4H)tetrone
459153221
C1C2C3C(C(C1=O)CC2=O)C(=O)N(C3=O)C4=CC=CC=C4
InChI=1SC16H13NO4c18116912(19)710(11)1413(9)15(20)17(16(14)21)8421358h159101314H67H2
MFCD03008652
ZINC000100813119
ZINC000102687052

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Available files

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