1-[2-(1-adamantyl)-6-azanyl-3-methoxy-phenyl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[2-(1-adamantyl)-6-azanyl-3-methoxy-phenyl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[2-(1-adamantyl)-6-amino-3-methoxy-phenyl]-2,2,2-trifluoro-ethanone CAS Name: 1-[2-(1-adamantyl)-6-amino-3-methoxyphenyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[2-(1-adamantyl)-6-amino-3-methoxyphenyl]-2,2,2-trifluoroethanone Traditional Name: 1-[2-(1-adamantyl)-6-amino-3-methoxy-phenyl]-2,2,2-trifluoro-ethanone Formula: C19H22F3NO2 MolecularWeight: 353.37869

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)N)C(=O)C(F)(F)F)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C(=C(C=C1)N)C(=O)C(F)(F)F)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H22F3NO2/c1-25-14-3-2-13(23)15(17(24)19(20,21)22)16(14)18-7-10-4-11(8-18)6-12(5-10)9-18/h2-3,10-12H,4-9,23H2,1H3