(5-chloranylquinolin-8-yl) 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate

Systemtic Name: (5-chloranylquinolin-8-yl) 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate Openeye Name: (5-chloro-8-quinolyl) 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxylic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylic acid (5-chloro-8-quinolyl) ester Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)OC5=C6C(=C(C=C5)Cl)C=CC=N6

Isomeric SMILES

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)OC5=C6C(=C(C=C5)Cl)C=CC=N6

InChI

InChI=1S/C25H27ClN2O3/c26-19-5-6-21(22-18(19)3-1-7-27-22)31-23(29)20-4-2-8-28(20)24(30)25-12-15-9-16(13-25)11-17(10-15)14-25/h1,3,5-7,15-17,20H,2,4,8-14H2