3-[[7-(1-oxidanyl-2-phenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]chromen-4-one

Systemtic Name: 3-[[7-(1-oxidanyl-2-phenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]chromen-4-one Openeye Name: 3-[[7-(1-hydroxy-2-phenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]chromen-4-one CAS Name: 3-[[7-(1-hydroxy-2-phenylethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[7-(1-hydroxy-2-phenylethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]chromen-4-one Traditional Name: 3-[[7-(1-hydroxy-2-phenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]chromone Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=COC4=CC=CC=C4C3=O)C=C(C=C2)C(CC5=CC=CC=C5)O

Isomeric SMILES

C1COC2=C(CN1CC3=COC4=CC=CC=C4C3=O)C=C(C=C2)C(CC5=CC=CC=C5)O

InChI

InChI=1S/C27H25NO4/c29-24(14-19-6-2-1-3-7-19)20-10-11-25-21(15-20)16-28(12-13-31-25)17-22-18-32-26-9-5-4-8-23(26)27(22)30/h1-11,15,18,24,29H,12-14,16-17H2