1-(2-fluorophenyl)-4-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]piperidin-4-ol

Systemtic Name: 1-(2-fluorophenyl)-4-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]piperidin-4-ol Openeye Name: 1-(2-fluorophenyl)-4-[4-(2-thienylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]piperidin-4-ol CAS Name: 1-(2-fluorophenyl)-4-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-4-piperidinol IUPAC Name: 1-(2-fluorophenyl)-4-[4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]piperidin-4-ol Traditional Name: 1-(2-fluorophenyl)-4-[4-(2-thenyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]piperidin-4-ol Formula: C25H27FN2O2S MolecularWeight: 438.557483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC3=C(C=C2)OCCN(C3)CC4=CC=CS4)O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCC1(C2=CC3=C(C=C2)OCCN(C3)CC4=CC=CS4)O)C5=CC=CC=C5F

InChI

InChI=1S/C25H27FN2O2S/c26-22-5-1-2-6-23(22)28-11-9-25(29,10-12-28)20-7-8-24-19(16-20)17-27(13-14-30-24)18-21-4-3-15-31-21/h1-8,15-16,29H,9-14,17-18H2