N-[4-(4-chlorophenyl)-4-oxidanyl-2,2-diphenyl-5-piperidin-1-yl-pentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide

Systemtic Name: N-[4-(4-chlorophenyl)-4-oxidanyl-2,2-diphenyl-5-piperidin-1-yl-pentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Openeye Name: N-[4-(4-chlorophenyl)-4-hydroxy-2,2-diphenyl-5-(1-piperidyl)pentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide CAS Name: N-[4-(4-chlorophenyl)-4-hydroxy-2,2-diphenyl-5-(1-piperidinyl)pentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide IUPAC Name: N-[4-(4-chlorophenyl)-4-hydroxy-2,2-diphenyl-5-piperidin-1-ylpentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Traditional Name: N-[4-(4-chlorophenyl)-4-hydroxy-2,2-diphenyl-5-piperidino-pentyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Formula: C39H44ClN3O2 MolecularWeight: 622.23856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CC(CNC(=O)N2CCC3=CC=CC=C3CC2)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=C(C=C6)Cl)O

Isomeric SMILES

C1CCN(CC1)CC(CC(CNC(=O)N2CCC3=CC=CC=C3CC2)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=C(C=C6)Cl)O

InChI

InChI=1S/C39H44ClN3O2/c40-36-20-18-35(19-21-36)39(45,30-42-24-10-3-11-25-42)28-38(33-14-4-1-5-15-33,34-16-6-2-7-17-34)29-41-37(44)43-26-22-31-12-8-9-13-32(31)23-27-43/h1-2,4-9,12-21,45H,3,10-11,22-30H2,(H,41,44)