Vitas-M small molecule compound
2-{3-[2-(4-methylphenyl)-2-oxoethoxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK252787
SMILES Cc1ccc(cc1)C(=O)COc1cccc(c1)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 C24H21NO4 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21NO4/c1-14-5-7-15(8-6-14)20(26)13-29-19-4-2-3-18(12-19)25-23(27)21-16-9-10-17(11-16)22(21)24(25)28/h2-10,12,16-17,21-22H,11,13H2,1H3InChIKey
APNUKLSWDSSZNK-UHFFFAOYSA-NSynonyms
2(3(2(4methylphenyl)2oxoethoxy)phenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=CC=C(C=C1)C(=O)COC2=CC=CC(=C2)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC24H21NO4c1145715(8614)20(26)13291942318(1219)2523(27)211691017(1116)22(21)24(25)28h2101216172122H1113H21H3
MFCD03145829
ZINC000100913629
ZINC000101880051
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