Vitas-M small molecule compound
2-{2-[2-(3,4-dimethylphenyl)-2-oxoethoxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK274844
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1OCC(=O)c1ccc(c(c1)C)C)C3
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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 C25H23NO4 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23NO4/c1-14-7-8-16(11-15(14)2)20(27)13-30-21-6-4-3-5-19(21)26-24(28)22-17-9-10-18(12-17)23(22)25(26)29/h3-11,17-18,22-23H,12-13H2,1-2H3InChIKey
JVDJVBTZNXPUJT-UHFFFAOYSA-NSynonyms
2(2(2(34dimethylphenyl)2oxoethoxy)phenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=C(C=C(C=C1)C(=O)COC2=CC=CC=C2N3C(=O)C4C5CC(C4C3=O)C=C5)C
InChI=1SC25H23NO4c1147816(1115(14)2)20(27)133021643519(21)2624(28)221791018(1217)23(22)25(26)29h31117182223H1213H212H3
MFCD03146300
ZINC000100921489
ZINC000244700849
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