N-[3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[(5-bromo-2-fluoro-phenyl)methylamino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[(5-bromo-2-fluorophenyl)methylamino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[(5-bromo-2-fluorophenyl)methylamino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[(5-bromo-2-fluoro-benzyl)amino]-3-keto-propyl]adamantane-1-carboxamide Formula: C21H26BrFN2O2 MolecularWeight: 437.345743

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NCC4=C(C=CC(=C4)Br)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NCC4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C21H26BrFN2O2/c22-17-1-2-18(23)16(8-17)12-25-19(26)3-4-24-20(27)21-9-13-5-14(10-21)7-15(6-13)11-21/h1-2,8,13-15H,3-7,9-12H2,(H,24,27)(H,25,26)