Vitas-M small molecule compound
4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-3-(piperidin-1-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK403777
SMILES COc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)N1CCCCC1
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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 C23H27N3O6 MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O6/c1-13-19(23(29)25-9-4-3-5-10-25)20(21-15(24-13)7-6-8-17(21)27)14-11-16(26(30)31)22(28)18(12-14)32-2/h11-12,20,24,28H,3-10H2,1-2H3InChIKey
MKTFFFATUVLMLK-UHFFFAOYSA-NSynonyms
4(4hydroxy3methoxy5nitrophenyl)2methyl3(piperidin1ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(4hydroxy3methoxy5nitrophenyl)2methyl3(piperidine1carbonyl)4678tetrahydro1Hquinolin5one
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)OC)O)(N+)(=O)(O))C(=O)N4CCCCC4
COc1cc(cc(c1O)(N+)(=O)(O))C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)N1CCCCC1
InChI=1SC23H27N3O6c11319(23(29)2594351025)20(2115(2413)76817(21)27)141116(26(30)31)22(28)18(1214)322h1112202428H310H212H3
MFCD03632509
ZINC000001134617
ZINC000001134618
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