Vitas-M small molecule compound
3-[(5-fluoro-2-methylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
Catalog ID
STK474662
SMILES O=C(C1C2CCC(C1C(=O)O)CC2)Nc1cc(F)ccc1C
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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 C17H20FNO3 MW 305.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20FNO3/c1-9-2-7-12(18)8-13(9)19-16(20)14-10-3-5-11(6-4-10)15(14)17(21)22/h2,7-8,10-11,14-15H,3-6H2,1H3,(H,19,20)(H,21,22)InChIKey
ONRIVDCJWZRPMT-UHFFFAOYSA-NSynonyms
2((5FLUORO2METHYLPHENYL)CARBAMOYL)BICYCLO(222)OCTANE3CARBOXYLICACID
3((5fluoro2methylphenyl)carbamoyl)bicyclo(222)octane2carboxylicacid
CC1=C(C=C(C=C1)F)NC(=O)C2C3CCC(C2C(=O)O)CC3
InChI=1SC17H20FNO3c192712(18)813(9)1916(20)14103511(6410)15(14)17(21)22h27810111415H36H21H3(H1920)(H2122)
MFCD06059220
ZINC000006727125
ZINC000006727128
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