2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol

Systemtic Name: 2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol Openeye Name: 2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol CAS Name: 2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol IUPAC Name: 2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol Traditional Name: 2-[4-[[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]phenoxy]ethanol Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CC2=CC=CC=C2O1)CC3=CC=C(C=C3)OCCO

Isomeric SMILES

CCCC[C@H]1CN(CC2=CC=CC=C2O1)CC3=CC=C(C=C3)OCCO

InChI

InChI=1S/C22H29NO3/c1-2-3-7-21-17-23(16-19-6-4-5-8-22(19)26-21)15-18-9-11-20(12-10-18)25-14-13-24/h4-6,8-12,21,24H,2-3,7,13-17H2,1H3/t21-/m0/s1