Vitas-M small molecule compound
methyl 4-{4-[(3-fluorobenzyl)oxy]-3-nitrophenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK959525
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)[N+](=O)[O-])OCc1cccc(c1)F)C(=O)CCC2
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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 C25H23FN2O6 MW 466.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23FN2O6/c1-14-22(25(30)33-2)23(24-18(27-14)7-4-8-20(24)29)16-9-10-21(19(12-16)28(31)32)34-13-15-5-3-6-17(26)11-15/h3,5-6,9-12,23,27H,4,7-8,13H2,1-2H3InChIKey
RSZMCLIRZZKKSC-UHFFFAOYSA-NSynonyms
397875-13-7397875137
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)(N+)(=O)(O))C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)(N+)(=O)(O))OCc1cccc(c1)F)C(=O)CCC2
InChI=1SC25H23FN2O6c11422(25(30)332)23(2418(2714)74820(24)29)1691021(19(1216)28(31)32)34131553617(26)1115h3569122327H47813H212H3
methyl4(4((3fluorobenzyl)oxy)3nitrophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4((3fluorophenyl)methoxy)3nitrophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02175364
ZINC000000654783
ZINC000000654786
Check stock
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