Vitas-M small molecule compound
6-methyl 3-propyl 2,7-dimethyl-4-(4-methyl-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404507
SMILES CCCOC(=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 C24H28N2O7 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O7/c1-6-9-33-24(29)19-14(4)25-16-10-13(3)18(23(28)32-5)22(27)21(16)20(19)15-8-7-12(2)17(11-15)26(30)31/h7-8,11,13,18,20,25H,6,9-10H2,1-5H3InChIKey
INXFHOLYOCHHAN-UHFFFAOYSA-NSynonyms
6methyl3propyl27dimethyl4(4methyl3nitrophenyl)5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropyl27dimethyl4(4methyl3nitrophenyl)5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)(N+)(=O)(O))C)C(=O)C(C(C2)C)C(=O)OC
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)C)(N+)(=O)(O))C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC24H28N2O7c1693324(29)1914(4)25161013(3)18(23(28)325)22(27)21(16)20(19)158712(2)17(1115)26(30)31h781113182025H6910H215H3
MFCD04226255
ZINC000020561137
ZINC000033834229
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