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

Systemtic Name: 8-chloranyl-5-(phenylmethyl)-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-benzyl-8-chloro-10-piperazin-1-yl-benzo[b][1,4]benzoxazepin-6-one CAS Name: 8-chloro-5-(phenylmethyl)-10-(1-piperazinyl)-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-benzyl-8-chloro-10-piperazin-1-ylbenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-benzyl-8-chloro-10-piperazino-benzo[b][1,4]benzoxazepin-6-one Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C(=CC(=C2)Cl)C(=O)N(C4=CC=CC=C4O3)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=C3C(=CC(=C2)Cl)C(=O)N(C4=CC=CC=C4O3)CC5=CC=CC=C5

InChI

InChI=1S/C24H22ClN3O2/c25-18-14-19-23(21(15-18)27-12-10-26-11-13-27)30-22-9-5-4-8-20(22)28(24(19)29)16-17-6-2-1-3-7-17/h1-9,14-15,26H,10-13,16H2