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

Systemtic Name: (2S)-2-[4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-propan-2-ol Openeye Name: (2S)-2-(4-isobutyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-1-phenoxy-propan-2-ol CAS Name: (2S)-2-[4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-2-propanol IUPAC Name: (2S)-2-[4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxypropan-2-ol Traditional Name: (2S)-2-(4-isobutyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-1-phenoxy-propan-2-ol Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC2=C(C1)C=C(C=C2)C(C)(COC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CN1CCOC2=C(C1)C=C(C=C2)[C@@](C)(COC3=CC=CC=C3)O

InChI

InChI=1S/C22H29NO3/c1-17(2)14-23-11-12-25-21-10-9-19(13-18(21)15-23)22(3,24)16-26-20-7-5-4-6-8-20/h4-10,13,17,24H,11-12,14-16H2,1-3H3/t22-/m1/s1