1-[7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenyl-ethanone

Systemtic Name: 1-[7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenyl-ethanone Openeye Name: 1-[7-(o-tolyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenyl-ethanone CAS Name: 1-[7-(2-methylphenyl)-9-(3-oxolanylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenylethanone IUPAC Name: 1-[7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenylethanone Traditional Name: 1-[7-(o-tolyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2,2-diphenyl-ethanone Formula: C35H35NO4 MolecularWeight: 533.6567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OCC4CCOC4)OCCN(C3)C(=O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OCC4CCOC4)OCCN(C3)C(=O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H35NO4/c1-25-10-8-9-15-31(25)29-20-30-22-36(17-19-39-34(30)32(21-29)40-24-26-16-18-38-23-26)35(37)33(27-11-4-2-5-12-27)28-13-6-3-7-14-28/h2-15,20-21,26,33H,16-19,22-24H2,1H3