7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride

Systemtic Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride Openeye Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride CAS Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(4-oxanyl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride IUPAC Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride Traditional Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1-propyl-2,3-dihydro-1-benzazepine-4-carboxamide dihydrochloride Formula: C39H53Cl2N3O4 MolecularWeight: 698.76182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)CCC.Cl.Cl

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)CCC.Cl.Cl

InChI

InChI=1S/C39H51N3O4.2ClH/c1-4-6-22-44-25-26-46-37-14-9-31(10-15-37)32-11-16-38-34(27-32)28-33(17-21-42(38)20-5-2)39(43)40-35-12-7-30(8-13-35)29-41(3)36-18-23-45-24-19-36;;/h7-16,27-28,36H,4-6,17-26,29H2,1-3H3,(H,40,43);2*1H