2-[(4-aminophenyl)methyl]-8-[[3-(trifluoromethyl)phenyl]methyl]cyclooctan-1-one

Systemtic Name: 2-[(4-aminophenyl)methyl]-8-[[3-(trifluoromethyl)phenyl]methyl]cyclooctan-1-one Openeye Name: 2-[(4-aminophenyl)methyl]-8-[[3-(trifluoromethyl)phenyl]methyl]cyclooctanone CAS Name: 2-[(4-aminophenyl)methyl]-8-[[3-(trifluoromethyl)phenyl]methyl]-1-cyclooctanone IUPAC Name: 2-[(4-aminophenyl)methyl]-8-[[3-(trifluoromethyl)phenyl]methyl]cyclooctan-1-one Traditional Name: 2-(4-aminobenzyl)-8-[3-(trifluoromethyl)benzyl]cyclooctanone Formula: C23H26F3NO MolecularWeight: 389.45385

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)C(CC1)CC2=CC(=CC=C2)C(F)(F)F)CC3=CC=C(C=C3)N

Isomeric SMILES

C1CCC(C(=O)C(CC1)CC2=CC(=CC=C2)C(F)(F)F)CC3=CC=C(C=C3)N

InChI

InChI=1S/C23H26F3NO/c24-23(25,26)20-8-4-5-17(15-20)14-19-7-3-1-2-6-18(22(19)28)13-16-9-11-21(27)12-10-16/h4-5,8-12,15,18-19H,1-3,6-7,13-14,27H2