2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-quinolin-5-yl-propanamide

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-quinolin-5-yl-propanamide Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-(5-quinolyl)propanamide CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-(5-quinolinyl)propanamide IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-quinolin-5-ylpropanamide Traditional Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-(5-quinolyl)propionamide Formula: C21H27N3O MolecularWeight: 337.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)N3CCC4CCCCC4C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)N3CCC4CCCCC4C3

InChI

InChI=1S/C21H27N3O/c1-15(24-13-11-16-6-2-3-7-17(16)14-24)21(25)23-20-10-4-9-19-18(20)8-5-12-22-19/h4-5,8-10,12,15-17H,2-3,6-7,11,13-14H2,1H3,(H,23,25)