Vitas-M small molecule compound
3-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl octanoate
Catalog ID
STK268619
SMILES CCCCCCCC(=O)Oc1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C(C1Br)Br
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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 C23H27Br2NO4 MW 541.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27Br2NO4/c1-2-3-4-5-6-10-17(27)30-14-9-7-8-13(11-14)26-22(28)18-15-12-16(19(18)23(26)29)21(25)20(15)24/h7-9,11,15-16,18-21H,2-6,10,12H2,1H3InChIKey
BCYXZGBFKZQIMN-UHFFFAOYSA-NSynonyms
3(56dibromo13dioxooctahydro2H47methanoisoindol2yl)phenyloctanoate
CCCCCCCC(=O)OC1=CC=CC(=C1)N2C(=O)C3C4CC(C3C2=O)C(C4Br)Br
InChI=1SC23H27Br2NO4c1234561017(27)301497813(1114)2622(28)18151216(19(18)23(26)29)21(25)20(15)24h791115161821H261012H21H3
MFCD01174777
ZINC000239275052
ZINC000239275055
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