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

Systemtic Name: 5-(decanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 5-(decanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(4-morpholinyl)propyl]-5-(1-oxodecylamino)benzamide IUPAC Name: 5-(decanoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 5-(caprylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)benzamide Formula: C33H48N4O3 MolecularWeight: 548.75922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H48N4O3/c1-2-3-4-5-6-7-8-14-32(38)35-29-15-16-31(37-20-17-27-12-9-10-13-28(27)26-37)30(25-29)33(39)34-18-11-19-36-21-23-40-24-22-36/h9-10,12-13,15-16,25H,2-8,11,14,17-24,26H2,1H3,(H,34,39)(H,35,38)