(2S)-2-[4-[(3-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-propan-2-ol

Systemtic Name: (2S)-2-[4-[(3-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-propan-2-ol Openeye Name: (2S)-2-[4-[(3-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-propan-2-ol CAS Name: (2S)-2-[4-[(3-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-2-propanol IUPAC Name: (2S)-2-[4-[(3-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxypropan-2-ol Traditional Name: (2S)-2-(4-m-anisyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-1-phenoxy-propan-2-ol Formula: C26H29NO4 MolecularWeight: 419.51276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)(C2=CC3=C(C=C2)OCCN(C3)CC4=CC(=CC=C4)OC)O

Isomeric SMILES

C[C@@](COC1=CC=CC=C1)(C2=CC3=C(C=C2)OCCN(C3)CC4=CC(=CC=C4)OC)O

InChI

InChI=1S/C26H29NO4/c1-26(28,19-31-23-8-4-3-5-9-23)22-11-12-25-21(16-22)18-27(13-14-30-25)17-20-7-6-10-24(15-20)29-2/h3-12,15-16,28H,13-14,17-19H2,1-2H3/t26-/m1/s1