1-(1-adamantylcarbonyl)-N-[4-[(2-oxidanylidenepyridin-1-yl)methyl]phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[4-[(2-oxidanylidenepyridin-1-yl)methyl]phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[4-[(2-oxo-1-pyridyl)methyl]phenyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[4-[(2-oxopyridin-1-yl)methyl]phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[4-[(2-keto-1-pyridyl)methyl]phenyl]pyrrolidine-2-carboxamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=C(C=C5)CN6C=CC=CC6=O

Isomeric SMILES

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=C(C=C5)CN6C=CC=CC6=O

InChI

InChI=1S/C28H33N3O3/c32-25-5-1-2-10-30(25)18-19-6-8-23(9-7-19)29-26(33)24-4-3-11-31(24)27(34)28-15-20-12-21(16-28)14-22(13-20)17-28/h1-2,5-10,20-22,24H,3-4,11-18H2,(H,29,33)