Vitas-M small molecule compound
methyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK018820
SMILES COC(=O)C1=C(C)NC(=O)CC1c1ccc(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 C14H13ClN2O5 MW 324.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN2O5/c1-7-13(14(19)22-2)9(6-12(18)16-7)8-3-4-10(15)11(5-8)17(20)21/h3-5,9H,6H2,1-2H3,(H,16,18)InChIKey
NMCYFWRVPDQREG-UHFFFAOYSA-NSynonyms
329074-25-1329074251
CC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)Cl)(N+)(=O)(O))C(=O)OC
COC(=O)C1=C(C)NC(=O)CC1c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC14H13ClN2O5c1713(14(19)222)9(612(18)167)83410(15)11(58)17(20)21h359H6H212H3(H1618)
methyl4(4chloro3nitrophenyl)2methyl6oxo1456tetrahydropyridine3carboxylate
METHYL4(4CHLORO3NITROPHENYL)2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
METHYL4(4CHLORO3NITROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIDINE5CARBOXYLATE
MFCD01590114
STK018820
ZINC000000132130
ZINC000000132133
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