Vitas-M small molecule compound

4-[2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenoxy]benzonitrile

Catalog ID
STK372112
SMILES N#Cc1ccc(cc1)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 C22H16N2O3 MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O3/c23-12-13-5-9-16(10-6-13)27-18-4-2-1-3-17(18)24-21(25)19-14-7-8-15(11-14)20(19)22(24)26/h1-10,14-15,19-20H,11H2
InChIKey
SXMURYUIKQGWGU-UHFFFAOYSA-N
Synonyms
5277-85-0
4(2((3AR4S7S7AS)13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)PHENOXY)BENZONITRILE
4(2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenoxy)benzonitrile
5277850
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4OC5=CC=C(C=C5)C#N
InChI=1SC22H16N2O3c2312135916(10613)2718421317(18)2421(25)19147815(1114)20(19)22(24)26h11014151920H11H2
MFCD00496674
ZINC000100357630
ZINC000101625348

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Available files

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