2,3-dihydro-1-benzofuran-2-yl-[7-(1-oxidanyl-3-phenyl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone

Systemtic Name: 2,3-dihydro-1-benzofuran-2-yl-[7-(1-oxidanyl-3-phenyl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Openeye Name: 2,3-dihydrobenzofuran-2-yl-[7-(1-hydroxy-3-phenyl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: 2,3-dihydrobenzofuran-2-yl-[7-(1-hydroxy-3-phenylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone IUPAC Name: 2,3-dihydro-1-benzofuran-2-yl-[7-(1-hydroxy-3-phenylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Traditional Name: coumaran-2-yl-[7-(1-hydroxy-3-phenyl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C3CC4=CC=CC=C4O3)C=C(C=C2)C(CCC5=CC=CC=C5)O

Isomeric SMILES

C1COC2=C(CN1C(=O)C3CC4=CC=CC=C4O3)C=C(C=C2)C(CCC5=CC=CC=C5)O

InChI

InChI=1S/C27H27NO4/c29-23(12-10-19-6-2-1-3-7-19)20-11-13-24-22(16-20)18-28(14-15-31-24)27(30)26-17-21-8-4-5-9-25(21)32-26/h1-9,11,13,16,23,26,29H,10,12,14-15,17-18H2