4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[2-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-[(2-ketopyrrolidino)methyl]benzyl]benzamide Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC=C2CNC(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC=C2CNC(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H31N3O2/c33-28-10-5-16-32(28)21-27-9-4-2-7-25(27)18-30-29(34)24-13-11-22(12-14-24)19-31-17-15-23-6-1-3-8-26(23)20-31/h1-4,6-9,11-14H,5,10,15-21H2,(H,30,34)