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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(3-phenylprop-2-enoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(3-phenylprop-2-enoylamino)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(4-morpholinyl)propyl]-5-[(1-oxo-3-phenylprop-2-enyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(3-phenylprop-2-enoylamino)benzamide Traditional Name: 5-cinnamamido-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)benzamide Formula: C32H36N4O3 MolecularWeight: 524.65324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)C=CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)C=CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C32H36N4O3/c37-31(14-11-25-7-2-1-3-8-25)34-28-12-13-30(36-18-15-26-9-4-5-10-27(26)24-36)29(23-28)32(38)33-16-6-17-35-19-21-39-22-20-35/h1-5,7-14,23H,6,15-22,24H2,(H,33,38)(H,34,37)