Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-2-oxoethyl 3-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)propanoate
Catalog ID
STK268969
SMILES O=C(OCC(=O)c1ccc(c(c1)C)C)CCN1C(=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 C22H23Br2NO5 MW 541.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23Br2NO5/c1-10-3-4-12(7-11(10)2)15(26)9-30-16(27)5-6-25-21(28)17-13-8-14(18(17)22(25)29)20(24)19(13)23/h3-4,7,13-14,17-20H,5-6,8-9H2,1-2H3InChIKey
HZBUFJLPXPAAGQ-UHFFFAOYSA-NSynonyms
2(34dimethylphenyl)2oxoethyl3(56dibromo13dioxooctahydro2H47methanoisoindol2yl)propanoate
CC1=C(C=C(C=C1)C(=O)COC(=O)CCN2C(=O)C3C4CC(C3C2=O)C(C4Br)Br)C
InChI=1SC22H23Br2NO5c1103412(711(10)2)15(26)93016(27)562521(28)1713814(18(17)22(25)29)20(24)19(13)23h34713141720H5689H212H3
MFCD01577377
ZINC000239309963
ZINC000239309967
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