Vitas-M small molecule compound

3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)cyclohex-2-en-1-one

Catalog ID
STK335994
SMILES O=C1CCCC(=C1)Nc1ccc2c(c1)OCCO2

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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 C14H15NO3 MW 245.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15NO3/c16-12-3-1-2-10(8-12)15-11-4-5-13-14(9-11)18-7-6-17-13/h4-5,8-9,15H,1-3,6-7H2
InChIKey
OZGWJMLWIKXYQX-UHFFFAOYSA-N
Synonyms

3(23dihydro14benzodioxin6ylamino)cyclohex2en1one
C1CC(=CC(=O)C1)NC2=CC3=C(C=C2)OCCO3
InChI=1SC14H15NO3c161231210(812)1511451314(911)18761713h458915H1367H2
MFCD09964419
ZINC000018200755
ZINC18200755

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Available files

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