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

Systemtic Name: (2S)-2-[4-(3-methylbutyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-propan-2-ol Openeye Name: (2S)-2-(4-isopentyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-1-phenoxy-propan-2-ol CAS Name: (2S)-2-[4-(3-methylbutyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxy-2-propanol IUPAC Name: (2S)-2-[4-(3-methylbutyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-phenoxypropan-2-ol Traditional Name: (2S)-2-(4-isoamyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-1-phenoxy-propan-2-ol Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCOC2=C(C1)C=C(C=C2)C(C)(COC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CCN1CCOC2=C(C1)C=C(C=C2)[C@@](C)(COC3=CC=CC=C3)O

InChI

InChI=1S/C23H31NO3/c1-18(2)11-12-24-13-14-26-22-10-9-20(15-19(22)16-24)23(3,25)17-27-21-7-5-4-6-8-21/h4-10,15,18,25H,11-14,16-17H2,1-3H3/t23-/m1/s1