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

Systemtic Name: 4-fluoranyl-5-(phenylmethyl)-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-benzyl-4-fluoro-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one CAS Name: 4-fluoro-5-(phenylmethyl)-10-(1-piperazinyl)-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-benzyl-4-fluoro-10-piperazin-1-ylbenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-benzyl-4-fluoro-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=C(C(=CC=C4)F)N(C3=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OC4=C(C(=CC=C4)F)N(C3=O)CC5=CC=CC=C5

InChI

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