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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)-5-(3-phenylpropanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholinoethyl)-5-(3-phenylpropanoylamino)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-[(1-oxo-3-phenylpropyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)-5-(3-phenylpropanoylamino)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(hydrocinnamoylamino)-N-(2-morpholinoethyl)benzamide Formula: C31H36N4O3 MolecularWeight: 512.64254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)CCC4=CC=CC=C4)C(=O)NCCN5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)CCC4=CC=CC=C4)C(=O)NCCN5CCOCC5

InChI

InChI=1S/C31H36N4O3/c36-30(13-10-24-6-2-1-3-7-24)33-27-11-12-29(35-16-14-25-8-4-5-9-26(25)23-35)28(22-27)31(37)32-15-17-34-18-20-38-21-19-34/h1-9,11-12,22H,10,13-21,23H2,(H,32,37)(H,33,36)