4-methoxy-2-[[7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol

Systemtic Name: 4-methoxy-2-[[7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol Openeye Name: 4-methoxy-2-[[7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol CAS Name: 4-methoxy-2-[[7-(2-methylphenyl)-9-(3-oxolanyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol IUPAC Name: 4-methoxy-2-[[7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol Traditional Name: 4-methoxy-2-[[7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenol Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)CC5=C(C=CC(=C5)OC)O

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)CC5=C(C=CC(=C5)OC)O

InChI

InChI=1S/C28H31NO5/c1-19-5-3-4-6-25(19)20-13-22-17-29(16-21-14-23(31-2)7-8-26(21)30)10-12-33-28(22)27(15-20)34-24-9-11-32-18-24/h3-8,13-15,24,30H,9-12,16-18H2,1-2H3