Vitas-M small molecule compound
methyl 1-oxo-2-[1-(pyridin-4-yl)ethyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK779348
SMILES COC(=O)C1C2C=CC3(C1C(=O)N(C3)C(c1ccncc1)C)O2
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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 C17H18N2O4 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4/c1-10(11-4-7-18-8-5-11)19-9-17-6-3-12(23-17)13(16(21)22-2)14(17)15(19)20/h3-8,10,12-14H,9H2,1-2H3InChIKey
SNMHSCQHAKJYSK-UHFFFAOYSA-NSynonyms
CC(C1=CC=NC=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)OC
InChI=1SC17H18N2O4c110(1147188511)199176312(2317)13(16(21)222)14(17)15(19)20h38101214H9H212H3
methyl1oxo2(1(pyridin4yl)ethyl)123677ahexahydro3a6epoxyisoindole7carboxylate
MFCD05858428
ZINC000150326082
ZINC000239412302
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