Vitas-M small molecule compound

2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl diphenylacetate

Catalog ID
STK275205
SMILES O=C(C(c1ccccc1)c1ccccc1)Oc1ccccc1N1C(=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 C29H23NO4 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO4/c31-27-25-20-15-16-21(17-20)26(25)28(32)30(27)22-13-7-8-14-23(22)34-29(33)24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,20-21,24-26H,17H2
InChIKey
NEYYNMLFMBFZSA-UHFFFAOYSA-N
Synonyms

2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenyldiphenylacetate
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4OC(=O)C(C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC29H23NO4c31272520151621(1720)26(25)28(32)30(27)2213781423(22)3429(33)24(1893141018)19115261219h11620212426H17H2
MFCD03357372
ZINC000101903476
ZINC000101903486

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Available files

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