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

Systemtic Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-3-yl)amino]methyl]phenyl]-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 7-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-N-[4-[[methyl(tetrahydropyran-3-yl)amino]methyl]phenyl]-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(3-oxanyl)amino]methyl]phenyl]-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-3-yl)amino]methyl]phenyl]-1-(2-methylpropyl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 7-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-N-[4-[[methyl(tetrahydropyran-3-yl)amino]methyl]phenyl]-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C40H53N3O4 MolecularWeight: 639.86652

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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)C5CCCOC5)CC(C)C

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCCOC5)CC(C)C

InChI

InChI=1S/C40H53N3O4/c1-5-6-21-45-23-24-47-38-16-11-32(12-17-38)33-13-18-39-35(25-33)26-34(19-20-43(39)27-30(2)3)40(44)41-36-14-9-31(10-15-36)28-42(4)37-8-7-22-46-29-37/h9-18,25-26,30,37H,5-8,19-24,27-29H2,1-4H3,(H,41,44)