3-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[4-(4-fluorophenoxy)butyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[4-(4-fluorophenoxy)butyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[4-(4-fluorophenoxy)butyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[4-(4-fluorophenoxy)butyl]adamantane-1-carboxamide Formula: C21H27ClFNO2 MolecularWeight: 379.895983

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCCCCOC4=CC=C(C=C4)F

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCCCCOC4=CC=C(C=C4)F

InChI

InChI=1S/C21H27ClFNO2/c22-21-12-15-9-16(13-21)11-20(10-15,14-21)19(25)24-7-1-2-8-26-18-5-3-17(23)4-6-18/h3-6,15-16H,1-2,7-14H2,(H,24,25)