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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(2-phenoxyethanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-[(2-phenoxyacetyl)amino]benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(4-morpholinyl)propyl]-5-[(1-oxo-2-phenoxyethyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-[(2-phenoxyacetyl)amino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-[(2-phenoxyacetyl)amino]benzamide Formula: C31H36N4O4 MolecularWeight: 528.64194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)COC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)COC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C31H36N4O4/c36-30(23-39-27-9-2-1-3-10-27)33-26-11-12-29(35-16-13-24-7-4-5-8-25(24)22-35)28(21-26)31(37)32-14-6-15-34-17-19-38-20-18-34/h1-5,7-12,21H,6,13-20,22-23H2,(H,32,37)(H,33,36)