(5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[2-(4-fluorophenyl)ethyl]adamantane-1-carboxamide Formula: C21H27FN2O2 MolecularWeight: 358.449683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NCCC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)NCCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H27FN2O2/c1-14(25)24-21-11-16-8-17(12-21)10-20(9-16,13-21)19(26)23-7-6-15-2-4-18(22)5-3-15/h2-5,16-17H,6-13H2,1H3,(H,23,26)(H,24,25)/t16-,17+,20?,21?