1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazino]-2-phenoxy-ethanone Formula: C26H25N3O4 MolecularWeight: 443.4944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)COC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)COC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O4/c1-31-20-11-12-23-21(17-20)26(27-22-9-5-6-10-24(22)33-23)29-15-13-28(14-16-29)25(30)18-32-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3