3-(1-adamantyl)-1,1,1-tris(fluoranyl)-4-oxidanyl-4-phenyl-but-3-en-2-one

Systemtic Name: 3-(1-adamantyl)-1,1,1-tris(fluoranyl)-4-oxidanyl-4-phenyl-but-3-en-2-one Openeye Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-hydroxy-4-phenyl-but-3-en-2-one CAS Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-hydroxy-4-phenyl-3-buten-2-one IUPAC Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one Traditional Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-hydroxy-4-phenyl-but-3-en-2-one Formula: C20H21F3O2 MolecularWeight: 350.37475

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=C(C4=CC=CC=C4)O)C(=O)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=C(C4=CC=CC=C4)O)C(=O)C(F)(F)F

InChI

InChI=1S/C20H21F3O2/c21-20(22,23)18(25)16(17(24)15-4-2-1-3-5-15)19-9-12-6-13(10-19)8-14(7-12)11-19/h1-5,12-14,24H,6-11H2