Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK268976
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)OCC(=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 C26H23NO5 MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5/c1-14-7-8-16(11-15(14)2)21(28)13-32-26(31)19-5-3-4-6-20(19)27-24(29)22-17-9-10-18(12-17)23(22)25(27)30/h3-11,17-18,22-23H,12-13H2,1-2H3InChIKey
SWRWWTDDKKIXBK-UHFFFAOYSA-NSynonyms
2(34dimethylphenyl)2oxoethyl2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2N3C(=O)C4C5CC(C4C3=O)C=C5)C
InChI=1SC26H23NO5c1147816(1115(14)2)21(28)133226(31)19534620(19)2724(29)221791018(1217)23(22)25(27)30h31117182223H1213H212H3
MFCD01577470
ZINC000101228457
ZINC000239412579
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