1-(1-adamantylcarbonyl)-N-(6-chloranylquinolin-8-yl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-(6-chloranylquinolin-8-yl)pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-(6-chloro-8-quinolyl)pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-(6-chloro-8-quinolinyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-(6-chloroquinolin-8-yl)pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-(6-chloro-8-quinolyl)pyrrolidine-2-carboxamide Formula: C25H28ClN3O2 MolecularWeight: 437.96172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=C6C(=CC(=C5)Cl)C=CC=N6

Isomeric SMILES

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=C6C(=CC(=C5)Cl)C=CC=N6

InChI

InChI=1S/C25H28ClN3O2/c26-19-10-18-3-1-5-27-22(18)20(11-19)28-23(30)21-4-2-6-29(21)24(31)25-12-15-7-16(13-25)9-17(8-15)14-25/h1,3,5,10-11,15-17,21H,2,4,6-9,12-14H2,(H,28,30)