3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Formula: C25H27ClFNO MolecularWeight: 411.939383

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)NCCC4=CC=C(C=C4)F)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)NCCC4=CC=C(C=C4)F)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H27ClFNO/c26-21-5-3-20(4-6-21)24-12-18-11-19(13-24)15-25(14-18,16-24)23(29)28-10-9-17-1-7-22(27)8-2-17/h1-8,18-19H,9-16H2,(H,28,29)