(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-(4-phenylpiperazino)methanone Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)N3CC4=CC=CC=C4OC5=C3C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)N3CC4=CC=CC=C4OC5=C3C=C(C=C5)Cl

InChI

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