2-(4-ethanoylphenoxy)-1-[7-[(1R)-1-oxidanyl-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone

Systemtic Name: 2-(4-ethanoylphenoxy)-1-[7-[(1R)-1-oxidanyl-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Openeye Name: 2-(4-acetylphenoxy)-1-[7-[(1R)-1-hydroxy-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone CAS Name: 2-(4-acetylphenoxy)-1-[7-[(1R)-1-hydroxy-3-phenylpropyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone IUPAC Name: 2-(4-acetylphenoxy)-1-[7-[(1R)-1-hydroxy-3-phenylpropyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Traditional Name: 2-(4-acetylphenoxy)-1-[7-[(1R)-1-hydroxy-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCOC3=C(C2)C=C(C=C3)C(CCC4=CC=CC=C4)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCOC3=C(C2)C=C(C=C3)[C@@H](CCC4=CC=CC=C4)O

InChI

InChI=1S/C28H29NO5/c1-20(30)22-8-11-25(12-9-22)34-19-28(32)29-15-16-33-27-14-10-23(17-24(27)18-29)26(31)13-7-21-5-3-2-4-6-21/h2-6,8-12,14,17,26,31H,7,13,15-16,18-19H2,1H3/t26-/m1/s1