1-[[4-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-yl-piperidin-4-ol

Systemtic Name: 1-[[4-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-yl-piperidin-4-ol Openeye Name: 1-[[4-[(2-fluoro-5-methoxy-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridyl)piperidin-4-ol CAS Name: 1-[[4-[(2-fluoro-5-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridinyl)-4-piperidinol IUPAC Name: 1-[[4-[(2-fluoro-5-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-pyridin-3-ylpiperidin-4-ol Traditional Name: 1-[[4-(2-fluoro-5-methoxy-benzyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-4-(3-pyridyl)piperidin-4-ol Formula: C28H32FN3O3 MolecularWeight: 477.570383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)CN2CCOC3=C(C2)C=C(C=C3)CN4CCC(CC4)(C5=CN=CC=C5)O

Isomeric SMILES

COC1=CC(=C(C=C1)F)CN2CCOC3=C(C2)C=C(C=C3)CN4CCC(CC4)(C5=CN=CC=C5)O

InChI

InChI=1S/C28H32FN3O3/c1-34-25-5-6-26(29)22(16-25)19-32-13-14-35-27-7-4-21(15-23(27)20-32)18-31-11-8-28(33,9-12-31)24-3-2-10-30-17-24/h2-7,10,15-17,33H,8-9,11-14,18-20H2,1H3