Vitas-M small molecule compound
1-oxo-1-phenylpropan-2-yl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK269452
SMILES CC(C(=O)c1ccccc1)OC(=O)c1ccc(cc1)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 C25H21NO5 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5/c1-14(22(27)15-5-3-2-4-6-15)31-25(30)16-9-11-19(12-10-16)26-23(28)20-17-7-8-18(13-17)21(20)24(26)29/h2-12,14,17-18,20-21H,13H2,1H3InChIKey
CLBCBECJYCOTRF-UHFFFAOYSA-NSynonyms
1oxo1phenylpropan2yl4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC25H21NO5c114(22(27)155324615)3125(30)1691119(121016)2623(28)20177818(1317)21(20)24(26)29h2121417182021H13H21H3
MFCD02614353
ZINC000100603676
ZINC000239030854
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