Vitas-M small molecule compound
3-(2-methoxyethyl) 6-methyl 4-(4-chloro-3-nitrophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK213394
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)[N+](=O)[O-])Cl)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 C23H25ClN2O8 MW 492.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O8/c1-11-9-15-20(21(27)17(11)22(28)33-4)19(13-5-6-14(24)16(10-13)26(30)31)18(12(2)25-15)23(29)34-8-7-32-3/h5-6,10-11,17,19,25H,7-9H2,1-4H3InChIKey
IHCFMTBDKISOGP-UHFFFAOYSA-NSynonyms
3(2methoxyethyl)6methyl4(4chloro3nitrophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2methoxyethyl)6Omethyl4(4chloro3nitrophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCCOC)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C(=O)C1C(=O)OC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)C(C(C2)C)C(=O)OC
InChI=1SC23H25ClN2O8c11191520(21(27)17(11)22(28)334)19(135614(24)16(1013)26(30)31)18(12(2)2515)23(29)3487323h561011171925H79H214H3
MFCD06651852
ZINC000004788350
ZINC000004788398
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