2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(tetradecanoylamino)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(tetradecanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(tetradecanoylamino)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(4-morpholinyl)propyl]-5-(1-oxotetradecylamino)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(tetradecanoylamino)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(tetradecanoylamino)benzamide Formula: C37H56N4O3 MolecularWeight: 604.86554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C37H56N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-18-36(42)39-33-19-20-35(41-24-21-31-16-13-14-17-32(31)30-41)34(29-33)37(43)38-22-15-23-40-25-27-44-28-26-40/h13-14,16-17,19-20,29H,2-12,15,18,21-28,30H2,1H3,(H,38,43)(H,39,42)