(4-phenyl-2-adamantyl) 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: (4-phenyl-2-adamantyl) 2,2,2-tris(fluoranyl)ethanoate Openeye Name: (4-phenyl-2-adamantyl) 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid (4-phenyl-2-adamantyl) ester IUPAC Name: (4-phenyl-2-adamantyl) 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid (4-phenyl-2-adamantyl) ester Formula: C18H19F3O2 MolecularWeight: 324.33747

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1C(C(C2)C3OC(=O)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1C(C(C2)C3OC(=O)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C18H19F3O2/c19-18(20,21)17(22)23-16-13-7-10-6-12(9-13)15(14(16)8-10)11-4-2-1-3-5-11/h1-5,10,12-16H,6-9H2