Vitas-M small molecule compound
4-(7-chloro-1,3-benzodioxol-5-yl)-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Catalog ID
STL312011
SMILES O=C1Oc2cc(C)nc(c2C(C1)c1cc(Cl)c2c(c1)OCO2)O
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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 C16H12ClNO5 MW 333.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClNO5/c1-7-2-11-14(16(20)18-7)9(5-13(19)23-11)8-3-10(17)15-12(4-8)21-6-22-15/h2-4,9H,5-6H2,1H3,(H,18,20)InChIKey
OYJSUFKNTQZQIC-UHFFFAOYSA-NSynonyms
1435906-26-51435906265
4(7chloro13benzodioxol5yl)5hydroxy7methyl34dihydro2Hpyrano(32c)pyridin2one
4(7chloro13benzodioxol5yl)7methyl46dihydro3Hpyrano(32c)pyridine25dione
CC1=CC2=C(C(CC(=O)O2)C3=CC4=C(C(=C3)Cl)OCO4)C(=O)N1
InChI=1SC16H12ClNO5c1721114(16(20)187)9(513(19)2311)8310(17)1512(48)2162215h249H56H21H3(H1820)
MFCD28026420
ZINC000095474460
ZINC000095474461
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