5-[(4-fluorophenyl)methyl]-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-[(4-fluorophenyl)methyl]-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-[(4-fluorophenyl)methyl]-10-(1-piperazinyl)-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-[(4-fluorophenyl)methyl]-10-piperazin-1-ylbenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-(4-fluorobenzyl)-10-piperazino-benzo[b][1,4]benzoxazepin-6-one Formula: C24H22FN3O2 MolecularWeight: 403.448783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)F

InChI

InChI=1S/C24H22FN3O2/c25-18-10-8-17(9-11-18)16-28-20-5-1-2-7-22(20)30-23-19(24(28)29)4-3-6-21(23)27-14-12-26-13-15-27/h1-11,26H,12-16H2