Vitas-M small molecule compound
ethyl (5E)-4-(4-bromophenyl)-5-(hydroxyimino)-2,7,7-trimethyl-5,6,7,8-tetrahydroquinoline-3-carboxylate
Catalog ID
STL323163
SMILES CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Br)/C(=N/O)/CC(C2)(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 C21H23BrN2O3 MW 431.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O3/c1-5-27-20(25)17-12(2)23-15-10-21(3,4)11-16(24-26)19(15)18(17)13-6-8-14(22)9-7-13/h6-9,26H,5,10-11H2,1-4H3/b24-16+InChIKey
RMIGBNQSIOKYCX-LFVJCYFKSA-NSynonyms
317840-21-4(E)ethyl4(4bromophenyl)5(hydroxyimino)277trimethyl5678tetrahydroquinoline3carboxylate
317840214
CCOC(=O)C1=C(N=C2CC(CC(=NO)C2=C1C3=CC=C(C=C3)Br)(C)C)C
CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Br)C(=NO)CC(C2)(C)C
ethyl(5E)4(4bromophenyl)5(hydroxyimino)277trimethyl5678tetrahydroquinoline3carboxylate
ethyl(5E)4(4bromophenyl)5hydroxyimino277trimethyl68dihydroquinoline3carboxylate
InChI=1SC21H23BrN2O3c152720(25)1712(2)23151021(34)1116(2426)19(15)18(17)136814(22)9713h6926H51011H214H3b2416+
MFCD00806448
ZINC000008934222
ZINC103289096
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