Vitas-M small molecule compound
methyl 3-(3,4-dimethoxyphenyl)-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-8-carboxylate
Catalog ID
STL192618
SMILES COC(=O)c1ccc2c(c1)C1NC(=O)N(C(O2)(C1)C)c1ccc(c(c1)OC)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 C21H22N2O6 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6/c1-21-11-15(14-9-12(19(24)28-4)5-7-16(14)29-21)22-20(25)23(21)13-6-8-17(26-2)18(10-13)27-3/h5-10,15H,11H2,1-4H3,(H,22,25)InChIKey
HJMRDSBUNMEEMZ-UHFFFAOYSA-NSynonyms
899962-64-2899962642
CC12CC(C3=C(O1)C=CC(=C3)C(=O)OC)NC(=O)N2C4=CC(=C(C=C4)OC)OC
InChI=1SC21H22N2O6c1211115(14912(19(24)284)5716(14)2921)2220(25)23(21)136817(262)18(1013)273h51015H11H214H3(H2225)
methyl3(34dimethoxyphenyl)2methyl4oxo3456tetrahydro2H26methano135benzoxadiazocine8carboxylate
MFCD07650980
ZINC000004852871
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Check stock on Vitas-MAvailable files
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