(2E)-1-ethanoyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one

Systemtic Name: (2E)-1-ethanoyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one Openeye Name: (2E)-1-acetyl-2-[2-oxo-2-(p-tolyl)ethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one CAS Name: (2E)-1-acetyl-2-[2-(4-methylphenyl)-2-oxoethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one IUPAC Name: (2E)-1-acetyl-2-[2-(4-methylphenyl)-2-oxoethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one Traditional Name: (2E)-1-acetyl-2-[2-keto-2-(p-tolyl)ethylidene]-5,5-diphenyl-4,1-benzoxazepin-3-one Formula: C32H25NO4 MolecularWeight: 487.5452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C2C(=O)OC(C3=CC=CC=C3N2C(=O)C)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/2\C(=O)OC(C3=CC=CC=C3N2C(=O)C)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H25NO4/c1-22-17-19-24(20-18-22)30(35)21-29-31(36)37-32(25-11-5-3-6-12-25,26-13-7-4-8-14-26)27-15-9-10-16-28(27)33(29)23(2)34/h3-21H,1-2H3/b29-21+