1-[7-(1-oxidanyl-2,2-diphenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-pyridin-3-yl-ethanone

Systemtic Name: 1-[7-(1-oxidanyl-2,2-diphenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-pyridin-3-yl-ethanone Openeye Name: 1-[7-(1-hydroxy-2,2-diphenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(3-pyridyl)ethanone CAS Name: 1-[7-(1-hydroxy-2,2-diphenylethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(3-pyridinyl)ethanone IUPAC Name: 1-[7-(1-hydroxy-2,2-diphenylethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-pyridin-3-ylethanone Traditional Name: 1-[7-(1-hydroxy-2,2-diphenyl-ethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(3-pyridyl)ethanone Formula: C30H28N2O3 MolecularWeight: 464.55492

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)CC3=CN=CC=C3)C=C(C=C2)C(C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

C1COC2=C(CN1C(=O)CC3=CN=CC=C3)C=C(C=C2)C(C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C30H28N2O3/c33-28(18-22-8-7-15-31-20-22)32-16-17-35-27-14-13-25(19-26(27)21-32)30(34)29(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-15,19-20,29-30,34H,16-18,21H2