1-[4-[3-(3-azanyl-4-methyl-phenoxy)propoxy]-2-oxidanyl-3-[3,3,3-tris(fluoranyl)propyl]phenyl]ethanone

Systemtic Name: 1-[4-[3-(3-azanyl-4-methyl-phenoxy)propoxy]-2-oxidanyl-3-[3,3,3-tris(fluoranyl)propyl]phenyl]ethanone Openeye Name: 1-[4-[3-(3-amino-4-methyl-phenoxy)propoxy]-2-hydroxy-3-(3,3,3-trifluoropropyl)phenyl]ethanone CAS Name: 1-[4-[3-(3-amino-4-methylphenoxy)propoxy]-2-hydroxy-3-(3,3,3-trifluoropropyl)phenyl]ethanone IUPAC Name: 1-[4-[3-(3-amino-4-methylphenoxy)propoxy]-2-hydroxy-3-(3,3,3-trifluoropropyl)phenyl]ethanone Traditional Name: 1-[4-[3-(3-amino-4-methyl-phenoxy)propoxy]-2-hydroxy-3-(3,3,3-trifluoropropyl)phenyl]ethanone Formula: C21H24F3NO4 MolecularWeight: 411.41477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCCOC2=C(C(=C(C=C2)C(=O)C)O)CCC(F)(F)F)N

Isomeric SMILES

CC1=C(C=C(C=C1)OCCCOC2=C(C(=C(C=C2)C(=O)C)O)CCC(F)(F)F)N

InChI

InChI=1S/C21H24F3NO4/c1-13-4-5-15(12-18(13)25)28-10-3-11-29-19-7-6-16(14(2)26)20(27)17(19)8-9-21(22,23)24/h4-7,12,27H,3,8-11,25H2,1-2H3