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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(dodecanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(dodecanoylamino)-N-(2-morpholinoethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-(1-oxododecylamino)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(dodecanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(lauroylamino)-N-(2-morpholinoethyl)benzamide Formula: C34H50N4O3 MolecularWeight: 562.7858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCN4CCOCC4

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C34H50N4O3/c1-2-3-4-5-6-7-8-9-10-15-33(39)36-30-16-17-32(38-20-18-28-13-11-12-14-29(28)27-38)31(26-30)34(40)35-19-21-37-22-24-41-25-23-37/h11-14,16-17,26H,2-10,15,18-25,27H2,1H3,(H,35,40)(H,36,39)