[1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]azepan-1-yl]methanone

Systemtic Name: [1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]azepan-1-yl]methanone Openeye Name: [1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]azepan-1-yl]methanone CAS Name: [1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]-1-azepanyl]methanone IUPAC Name: [1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]azepan-1-yl]methanone Traditional Name: [1-(4-chlorophenyl)cyclobutyl]-[3-[[4-(trifluoromethyl)phenoxy]methyl]azepan-1-yl]methanone Formula: C25H27ClF3NO2 MolecularWeight: 465.93559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)COC2=CC=C(C=C2)C(F)(F)F)C(=O)C3(CCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC(C1)COC2=CC=C(C=C2)C(F)(F)F)C(=O)C3(CCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H27ClF3NO2/c26-21-9-5-19(6-10-21)24(13-3-14-24)23(31)30-15-2-1-4-18(16-30)17-32-22-11-7-20(8-12-22)25(27,28)29/h5-12,18H,1-4,13-17H2