Vitas-M small molecule compound

(1Z)-1-(4-bromophenyl)-N-hydroxy-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanimine

Catalog ID
STL537409
SMILES O/N=C(\c1ccc(cc1)Br)/CC1N(C)CCc2c1c(OC)c1c(c2)OCO1

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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 C20H21BrN2O4 MW 433.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O4/c1-23-8-7-13-9-17-19(27-11-26-17)20(25-2)18(13)16(23)10-15(22-24)12-3-5-14(21)6-4-12/h3-6,9,16,24H,7-8,10-11H2,1-2H3/b22-15-
InChIKey
YYOWXGPJVVRYIL-JCMHNJIXSA-N
Synonyms
400782-93-6
(~(N)~(Z))~(N)(1(4bromophenyl)2(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)ethylidene)hydroxylamine
(1Z)1(4bromophenyl)Nhydroxy2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanimine
(Z)1(4bromophenyl)2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanoneoxime
400782936
9641317
InChI=1SC20H21BrN2O4c123871391719(27112617)20(252)18(13)16(23)1015(2224)123514(21)6412h3691624H781011H212H3b2215
MFCD02115718
ON=C(c1ccc(cc1)Br)CC1N(C)CCc2c1c(OC)c1c(c2)OCO1
ZINC000020612408
ZINC000020612410

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Available files

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