Vitas-M small molecule compound

N-[7-(2-methylpropanoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enamide

Catalog ID
STL377031
SMILES C=CC(=O)Nc1cc2OCCOc2cc1C(=O)C(C)C

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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 C15H17NO4 MW 275.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO4/c1-4-14(17)16-11-8-13-12(19-5-6-20-13)7-10(11)15(18)9(2)3/h4,7-9H,1,5-6H2,2-3H3,(H,16,17)
InChIKey
JGJRUQQTWXHZGV-UHFFFAOYSA-N
Synonyms

CC(C)C(=O)C1=CC2=C(C=C1NC(=O)C=C)OCCO2
InChI=1SC15H17NO4c1414(17)161181312(19562013)710(11)15(18)9(2)3h479H156H223H3(H1617)
MFCD28952120
N(7(2methylpropanoyl)23dihydro14benzodioxin6yl)prop2enamide
ZINC000098086829
ZINC98086829

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Available files

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