Vitas-M small molecule compound
4-(4-chloro-3-nitrophenyl)-2,7,7-trimethyl-3-(piperidin-1-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK403800
SMILES CC1=C(C(=O)N2CCCCC2)C(C2=C(N1)CC(C)(C)CC2=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C24H28ClN3O4 MW 457.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN3O4/c1-14-20(23(30)27-9-5-4-6-10-27)21(15-7-8-16(25)18(11-15)28(31)32)22-17(26-14)12-24(2,3)13-19(22)29/h7-8,11,21,26H,4-6,9-10,12-13H2,1-3H3InChIKey
GAYFKTHMVIWGHV-UHFFFAOYSA-NSynonyms
4(4chloro3nitrophenyl)277trimethyl3(piperidin1ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(4chloro3nitrophenyl)277trimethyl3(piperidine1carbonyl)1468tetrahydroquinolin5one
CC1=C(C(=O)N2CCCCC2)C(C2=C(N1)CC(C)(C)CC2=O)c1ccc(c(c1)(N+)(=O)(O))Cl
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C(=O)N4CCCCC4
InChI=1SC24H28ClN3O4c11420(23(30)2795461027)21(157816(25)18(1115)28(31)32)2217(2614)1224(23)1319(22)29h78112126H469101213H213H3
MFCD03632536
ZINC000001134017
ZINC000001134018
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