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

Systemtic Name: [7-[(1R)-1-oxidanyl-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [7-[(1R)-1-hydroxy-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [7-[(1R)-1-hydroxy-3-phenylpropyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [7-[(1R)-1-hydroxy-3-phenylpropyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [7-[(1R)-1-hydroxy-3-phenyl-propyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C3=CC(=NN3)C4=CC=CC=C4)C=C(C=C2)C(CCC5=CC=CC=C5)O

Isomeric SMILES

C1COC2=C(CN1C(=O)C3=CC(=NN3)C4=CC=CC=C4)C=C(C=C2)[C@@H](CCC5=CC=CC=C5)O

InChI

InChI=1S/C28H27N3O3/c32-26(13-11-20-7-3-1-4-8-20)22-12-14-27-23(17-22)19-31(15-16-34-27)28(33)25-18-24(29-30-25)21-9-5-2-6-10-21/h1-10,12,14,17-18,26,32H,11,13,15-16,19H2,(H,29,30)/t26-/m1/s1