Vitas-M small molecule compound
2-phenoxyethyl 2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402323
SMILES O=C(C1=C(C)NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCC2)OCCOc1ccccc1
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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 C25H24N2O6 MW 448.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6/c1-16-22(25(29)33-14-13-32-19-9-3-2-4-10-19)23(17-7-5-8-18(15-17)27(30)31)24-20(26-16)11-6-12-21(24)28/h2-5,7-10,15,23,26H,6,11-14H2,1H3InChIKey
RIXYSWWBCWTHOH-UHFFFAOYSA-NSynonyms
313244-51-82phenoxyethyl2methyl4(3nitrophenyl)5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl2methyl4(3nitrophenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
313244518
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)OCCOC4=CC=CC=C4
InChI=1SC25H24N2O6c11622(25(29)331413321993241019)23(1775818(1517)27(30)31)2420(2616)1161221(24)28h25710152326H61114H21H3
MFCD01367220
O=C(C1=C(C)NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CCC2)OCCOc1ccccc1
ZINC000002082450
ZINC000002082451
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