3-(4-chlorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]adamantane-1-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]adamantane-1-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]adamantane-1-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[4-(trifluoromethyl)benzyl]adamantane-1-carboxamide Formula: C25H25ClF3NO MolecularWeight: 447.92031

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(F)(F)F)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(F)(F)F)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H25ClF3NO/c26-21-7-5-19(6-8-21)23-10-17-9-18(11-23)13-24(12-17,15-23)22(31)30-14-16-1-3-20(4-2-16)25(27,28)29/h1-8,17-18H,9-15H2,(H,30,31)