1-[3-(aminomethyl)-5-tert-butyl-2-oxidanyl-phenyl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[3-(aminomethyl)-5-tert-butyl-2-oxidanyl-phenyl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[3-(aminomethyl)-5-tert-butyl-2-hydroxy-phenyl]-2,2,2-trifluoro-ethanone CAS Name: 1-[3-(aminomethyl)-5-tert-butyl-2-hydroxyphenyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[3-(aminomethyl)-5-tert-butyl-2-hydroxyphenyl]-2,2,2-trifluoroethanone Traditional Name: 1-[3-(aminomethyl)-5-tert-butyl-2-hydroxy-phenyl]-2,2,2-trifluoro-ethanone Formula: C13H16F3NO2 MolecularWeight: 275.26685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)C(F)(F)F)O)CN

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)C(F)(F)F)O)CN

InChI

InChI=1S/C13H16F3NO2/c1-12(2,3)8-4-7(6-17)10(18)9(5-8)11(19)13(14,15)16/h4-5,18H,6,17H2,1-3H3