Vitas-M small molecule compound
pentyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK269215
SMILES CCCCCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1
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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 C21H23NO4 MW 353.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO4/c1-2-3-4-11-26-21(25)13-7-9-16(10-8-13)22-19(23)17-14-5-6-15(12-14)18(17)20(22)24/h5-10,14-15,17-18H,2-4,11-12H2,1H3InChIKey
FXSBFPIWUAJKCX-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C4CC(C3C2=O)C=C4
InChI=1SC21H23NO4c1234112621(25)137916(10813)2219(23)17145615(1214)18(17)20(22)24h51014151718H241112H21H3
MFCD02026643
pentyl4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
ZINC000100623974
ZINC000102608704
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