(2E)-2-[(4-chlorophenyl)methylidene]-5-oxidanyl-1,5-diphenyl-4,1-benzoxazepin-3-one

Systemtic Name: (2E)-2-[(4-chlorophenyl)methylidene]-5-oxidanyl-1,5-diphenyl-4,1-benzoxazepin-3-one Openeye Name: (2E)-2-[(4-chlorophenyl)methylene]-5-hydroxy-1,5-diphenyl-4,1-benzoxazepin-3-one CAS Name: (2E)-2-[(4-chlorophenyl)methylidene]-5-hydroxy-1,5-diphenyl-4,1-benzoxazepin-3-one IUPAC Name: (2E)-2-[(4-chlorophenyl)methylidene]-5-hydroxy-1,5-diphenyl-4,1-benzoxazepin-3-one Traditional Name: (2E)-2-(4-chlorobenzylidene)-5-hydroxy-1,5-diphenyl-4,1-benzoxazepin-3-one Formula: C28H20ClNO3 MolecularWeight: 453.9163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=CC=CC=C3N(C(=CC4=CC=C(C=C4)Cl)C(=O)O2)C5=CC=CC=C5)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=CC=CC=C3N(/C(=C/C4=CC=C(C=C4)Cl)/C(=O)O2)C5=CC=CC=C5)O

InChI

InChI=1S/C28H20ClNO3/c29-22-17-15-20(16-18-22)19-26-27(31)33-28(32,21-9-3-1-4-10-21)24-13-7-8-14-25(24)30(26)23-11-5-2-6-12-23/h1-19,32H/b26-19+