Vitas-M small molecule compound

4-(1,3-dioxooctahydro-2H-isoindol-2-yl)benzonitrile

Catalog ID
STK149439
SMILES N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)CCCC2

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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 C15H14N2O2 MW 254.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O2/c16-9-10-5-7-11(8-6-10)17-14(18)12-3-1-2-4-13(12)15(17)19/h5-8,12-13H,1-4H2
InChIKey
HDTIMHHDYBVFIQ-UHFFFAOYSA-N
Synonyms

4(13dioxo3a45677ahexahydroisoindol2yl)benzonitrile
4(13DIOXOOCTAHYDRO2HISOINDOL2YL)BENZONITRILE
C1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)C#N
InChI=1SC15H14N2O2c169105711(8610)1714(18)12312413(12)15(17)19h581213H14H2
MFCD01435904
ZINC000013880575
ZINC000100262517

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Available files

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