Vitas-M small molecule compound
8-cyclohexylidene-2-phenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STL329559
SMILES O=C1C2C(C(=O)N1c1ccccc1)C1C(=C3CCCCC3)C2C=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 C21H21NO2 MW 319.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO2/c23-20-18-15-11-12-16(17(15)13-7-3-1-4-8-13)19(18)21(24)22(20)14-9-5-2-6-10-14/h2,5-6,9-12,15-16,18-19H,1,3-4,7-8H2InChIKey
VGVPAIMZXLCLBI-UHFFFAOYSA-NSynonyms
(3aR4R7S7aS)8cyclohexylidene2phenyl3a477atetrahydro1H47methanoisoindole13(2H)dione
8cyclohexylidene2phenyl3a477atetrahydro1H47methanoisoindole13(2H)dione
C1CCC(=C2C3C=CC2C4C3C(=O)N(C4=O)C5=CC=CC=C5)CC1
InChI=1SC21H21NO2c23201815111216(17(15)137314813)19(18)21(24)22(20)1495261014h25691215161819H13478H2
MFCD01049367
ZINC000102680414
ZINC000102680419
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