N-[[4-(2-adamantylcarbamoyl)phenyl]methyl]-3-fluoranyl-benzamide

Systemtic Name: N-[[4-(2-adamantylcarbamoyl)phenyl]methyl]-3-fluoranyl-benzamide Openeye Name: N-[[4-(2-adamantylcarbamoyl)phenyl]methyl]-3-fluoro-benzamide CAS Name: N-[[4-[(2-adamantylamino)-oxomethyl]phenyl]methyl]-3-fluorobenzamide IUPAC Name: N-[[4-(2-adamantylcarbamoyl)phenyl]methyl]-3-fluorobenzamide Traditional Name: N-[4-(2-adamantylcarbamoyl)benzyl]-3-fluoro-benzamide Formula: C25H27FN2O2 MolecularWeight: 406.492483

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=C(C=C4)CNC(=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=C(C=C4)CNC(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C25H27FN2O2/c26-22-3-1-2-19(13-22)24(29)27-14-15-4-6-18(7-5-15)25(30)28-23-20-9-16-8-17(11-20)12-21(23)10-16/h1-7,13,16-17,20-21,23H,8-12,14H2,(H,27,29)(H,28,30)