N-[[methyl(oxan-4-yl)amino]methyl]-7-(4-morpholin-4-ylphenyl)-N-phenyl-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: N-[[methyl(oxan-4-yl)amino]methyl]-7-(4-morpholin-4-ylphenyl)-N-phenyl-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[[methyl(tetrahydropyran-4-yl)amino]methyl]-7-(4-morpholinophenyl)-N-phenyl-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-[[methyl(4-oxanyl)amino]methyl]-7-[4-(4-morpholinyl)phenyl]-N-phenyl-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-[[methyl(oxan-4-yl)amino]methyl]-7-(4-morpholin-4-ylphenyl)-N-phenyl-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-[[methyl(tetrahydropyran-4-yl)amino]methyl]-7-(4-morpholinophenyl)-N-phenyl-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C34H39N3O4 MolecularWeight: 553.69116

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)N5CCOCC5)OCC2)C6CCOCC6

Isomeric SMILES

CN(CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)N5CCOCC5)OCC2)C6CCOCC6

InChI

InChI=1S/C34H39N3O4/c1-35(30-14-18-39-19-15-30)25-37(32-5-3-2-4-6-32)34(38)28-13-20-41-33-12-9-27(23-29(33)24-28)26-7-10-31(11-8-26)36-16-21-40-22-17-36/h2-12,23-24,30H,13-22,25H2,1H3