Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-10-methoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL094857
SMILES COc1cccc2c1OC1(C)CC2NC(=O)N1c1ccc2c(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 C20H20N2O5 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5/c1-20-11-14(13-4-3-5-16(24-2)18(13)27-20)21-19(23)22(20)12-6-7-15-17(10-12)26-9-8-25-15/h3-7,10,14H,8-9,11H2,1-2H3,(H,21,23)InChIKey
DKSIQCMIMLHYEP-UHFFFAOYSA-NSynonyms
899986-48-23(23dihydro14benzodioxin6yl)10methoxy2methyl2356tetrahydro4H26methano135benzoxadiazocin4one
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)10METHOXY2METHYL56DIHYDRO2H26METHANOBENZO(G)(135)OXADIAZOCIN4(3H)ONE
899986482
CC12CC(C3=C(O1)C(=CC=C3)OC)NC(=O)N2C4=CC5=C(C=C4)OCCO5
InChI=1SC20H20N2O5c1201114(1343516(242)18(13)2720)2119(23)22(20)12671517(1012)26982515h371014H8911H212H3(H2123)
MFCD07650940
ZINC000101084857
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