Vitas-M small molecule compound
2-methyl-4-(4-methyl-3-nitrophenyl)-3-(piperidin-1-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK403748
SMILES CC1=C(C(=O)N2CCCCC2)C(C2=C(N1)CCCC2=O)c1ccc(c(c1)[N+](=O)[O-])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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-14-9-10-16(13-18(14)26(29)30)21-20(23(28)25-11-4-3-5-12-25)15(2)24-17-7-6-8-19(27)22(17)21/h9-10,13,21,24H,3-8,11-12H2,1-2H3InChIKey
DLKBLTSGAPGIEO-UHFFFAOYSA-NSynonyms
2methyl4(4methyl3nitrophenyl)3(piperidin1ylcarbonyl)4678tetrahydroquinolin5(1H)one
2methyl4(4methyl3nitrophenyl)3(piperidine1carbonyl)4678tetrahydro1Hquinolin5one
CC1=C(C(=O)N2CCCCC2)C(C2=C(N1)CCCC2=O)c1ccc(c(c1)(N+)(=O)(O))C
CC1=C(C=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)N4CCCCC4)C)(N+)(=O)(O)
InChI=1SC23H27N3O4c11491016(1318(14)26(29)30)2120(23(28)25114351225)15(2)241776819(27)22(17)21h910132124H381112H212H3
MFCD03632478
ZINC000004687726
ZINC000004687727
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