Vitas-M small molecule compound

N-(1,2-dihydroacenaphthylen-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Catalog ID
STK248053
SMILES O=C(c1ccc2c(c1)OCCO2)Nc1ccc2c3c1cccc3CC2

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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 C21H17NO3 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO3/c23-21(15-7-9-18-19(12-15)25-11-10-24-18)22-17-8-6-14-5-4-13-2-1-3-16(17)20(13)14/h1-3,6-9,12H,4-5,10-11H2,(H,22,23)
InChIKey
NWDSTNLBNNTEMH-UHFFFAOYSA-N
Synonyms
477555-31-0
477555310
C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC21H17NO3c2321(15791819(1215)2511102418)22178614541321316(17)20(13)14h136912H451011H2(H2223)
MFCD03062189
N(12DIHYDRO5ACENAPHTHYLENYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
N(12dihydroacenaphthylen5yl)23dihydro14benzodioxine6carboxamide
ZINC000000555994
ZINC00555994
ZINC555994

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Available files

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