5-phenethyl-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-phenethyl-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-phenethyl-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-phenethyl-10-(1-piperazinyl)-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-phenethyl-10-piperazin-1-ylbenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-phenethyl-10-piperazino-benzo[b][1,4]benzoxazepin-6-one Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OC4=CC=CC=C4N(C3=O)CCC5=CC=CC=C5

InChI

InChI=1S/C25H25N3O2/c29-25-20-9-6-11-22(27-17-14-26-15-18-27)24(20)30-23-12-5-4-10-21(23)28(25)16-13-19-7-2-1-3-8-19/h1-12,26H,13-18H2