4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-morpholin-4-ylphenyl)methyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-morpholin-4-ylphenyl)methyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-morpholinophenyl)methyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[4-(4-morpholinyl)phenyl]methyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-morpholin-4-ylphenyl)methyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-morpholinobenzyl)benzamide Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C28H31N3O2/c32-28(29-19-22-7-11-27(12-8-22)31-15-17-33-18-16-31)25-9-5-23(6-10-25)20-30-14-13-24-3-1-2-4-26(24)21-30/h1-12H,13-21H2,(H,29,32)