(5S,7R)-3-acetamido-N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[1-(furan-2-carbonyl)-4-piperidyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[1-(furan-2-carbonyl)piperidin-4-yl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[1-(2-furoyl)-4-piperidyl]adamantane-1-carboxamide Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NC4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)NC4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C23H31N3O4/c1-15(27)25-23-12-16-9-17(13-23)11-22(10-16,14-23)21(29)24-18-4-6-26(7-5-18)20(28)19-3-2-8-30-19/h2-3,8,16-18H,4-7,9-14H2,1H3,(H,24,29)(H,25,27)/t16-,17+,22?,23?