Vitas-M small molecule compound
methyl 2-chloro-5-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate
Catalog ID
STL387186
SMILES COC(=O)c1cc(ccc1Cl)N1C(=O)C2C(C1=O)C1(OC2C=C1)C
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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 C17H14ClNO5 MW 347.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClNO5/c1-17-6-5-11(24-17)12-13(17)15(21)19(14(12)20)8-3-4-10(18)9(7-8)16(22)23-2/h3-7,11-13H,1-2H3InChIKey
FCBUFYFFWZMHFV-UHFFFAOYSA-NSynonyms
CC12C=CC(O1)C3C2C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)C(=O)OC
InChI=1SC17H14ClNO5c1176511(2417)1213(17)15(21)19(14(12)20)83410(18)9(78)16(22)232h371113H12H3
methyl2chloro5(4methyl13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzoate
methyl2chloro5(7methyl13dioxo47adihydro3aHoctahydro1H47epoxyisoindol2yl)benzoate
MFCD01142137
ZINC000100179295
ZINC000101358164
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