Vitas-M small molecule compound
3-(2-methoxyethyl) 6-methyl 2,7-dimethyl-4-(4-methyl-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404694
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)[N+](=O)[O-])C)C(=O)C(C(C2)C)C(=O)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 C24H28N2O8 MW 472.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O8/c1-12-6-7-15(11-17(12)26(30)31)20-19(24(29)34-9-8-32-4)14(3)25-16-10-13(2)18(23(28)33-5)22(27)21(16)20/h6-7,11,13,18,20,25H,8-10H2,1-5H3InChIKey
FMUVUXYZCIMLHG-UHFFFAOYSA-NSynonyms
3(2methoxyethyl)6methyl27dimethyl4(4methyl3nitrophenyl)5oxo145678hexahydroquinoline36dicarboxylate
3O(2methoxyethyl)6Omethyl27dimethyl4(4methyl3nitrophenyl)5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCCOC)C3=CC(=C(C=C3)C)(N+)(=O)(O))C(=O)C1C(=O)OC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)(N+)(=O)(O))C)C(=O)C(C(C2)C)C(=O)OC
InChI=1SC24H28N2O8c1126715(1117(12)26(30)31)2019(24(29)3498324)14(3)25161013(2)18(23(28)335)22(27)21(16)20h671113182025H810H215H3
MFCD06193926
ZINC000020395847
ZINC000102559582
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