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

Systemtic Name: (5S,7R)-3-acetamido-N-[2-(2-fluoranylphenoxy)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[2-(2-fluorophenoxy)ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[2-(2-fluorophenoxy)ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[2-(2-fluorophenoxy)ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[2-(2-fluorophenoxy)ethyl]adamantane-1-carboxamide Formula: C21H27FN2O3 MolecularWeight: 374.449083

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NCCOC4=CC=CC=C4F

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)NCCOC4=CC=CC=C4F

InChI

InChI=1S/C21H27FN2O3/c1-14(25)24-21-11-15-8-16(12-21)10-20(9-15,13-21)19(26)23-6-7-27-18-5-3-2-4-17(18)22/h2-5,15-16H,6-13H2,1H3,(H,23,26)(H,24,25)/t15-,16+,20?,21?