Vitas-M small molecule compound
ethyl 7-(4-methoxyphenyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK031641
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)OC
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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 C26H26N2O6 MW 462.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O6/c1-4-34-26(30)23-15(2)27-21-13-18(16-8-10-20(33-3)11-9-16)14-22(29)25(21)24(23)17-6-5-7-19(12-17)28(31)32/h5-12,18,24,27H,4,13-14H2,1-3H3InChIKey
LZPDBOMBWHFKGX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)c1ccc(cc1)OC
CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)(N+)(=O)(O))C(=O)CC(C2)C4=CC=C(C=C4)OC)C
ethyl7(4methoxyphenyl)2methyl4(3nitrophenyl)5oxo145678hexahydroquinoline3carboxylate
ethyl7(4methoxyphenyl)2methyl4(3nitrophenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC26H26N2O6c143426(30)2315(2)27211318(1681020(333)11916)1422(29)25(21)24(23)1765719(1217)28(31)32h512182427H41314H213H3
MFCD01445592
STK031641
ZINC000000844540
ZINC000000844543
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