Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STK378718
SMILES O=C1C=C(Nc2ccc3c(c2)OCCO3)CC(C1)(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 C16H19NO3 MW 273.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO3/c1-16(2)9-12(7-13(18)10-16)17-11-3-4-14-15(8-11)20-6-5-19-14/h3-4,7-8,17H,5-6,9-10H2,1-2H3InChIKey
UJCQUMSZPQQONX-UHFFFAOYSA-NSynonyms
300568-54-13(23DIHYDRO14BENZODIOXIN6YLAMINO)55DIMETHYL1CYCLOHEX2ENONE
3(23dihydro14benzodioxin6ylamino)55dimethylcyclohex2en1one
3(2H3HBENZO(34E)14DIOXIN6YLAMINO)55DIMETHYLCYCLOHEX2EN1ONE
300568541
CC1(CC(=CC(=O)C1)NC2=CC3=C(C=C2)OCCO3)C
InChI=1SC16H19NO3c116(2)912(713(18)1016)1711341415(811)20651914h347817H56910H212H3
MFCD01873196
ZINC000003903064
ZINC03903064
ZINC137086467
ZINC230221928
ZINC3903064
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