5-[(3-chlorophenyl)methyl]-1-fluoranyl-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-[(3-chlorophenyl)methyl]-1-fluoranyl-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-[(3-chlorophenyl)methyl]-1-fluoro-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-[(3-chlorophenyl)methyl]-1-fluoro-10-(1-piperazinyl)-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-[(3-chlorophenyl)methyl]-1-fluoro-10-piperazin-1-ylbenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-(3-chlorobenzyl)-1-fluoro-10-piperazino-benzo[b][1,4]benzoxazepin-6-one Formula: C24H21ClFN3O2 MolecularWeight: 437.893843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OC4=C(C=CC=C4F)N(C3=O)CC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OC4=C(C=CC=C4F)N(C3=O)CC5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H21ClFN3O2/c25-17-5-1-4-16(14-17)15-29-21-9-3-7-19(26)23(21)31-22-18(24(29)30)6-2-8-20(22)28-12-10-27-11-13-28/h1-9,14,27H,10-13,15H2