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

Systemtic Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]-2-phenoxy-ethanone Formula: C27H27N3O4 MolecularWeight: 457.52098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC2=CC=CC=C2)C3=NC4=CC=CC=C4OC5=C3C=C(C=C5)OC

Isomeric SMILES

CC1CN(CCN1C(=O)COC2=CC=CC=C2)C3=NC4=CC=CC=C4OC5=C3C=C(C=C5)OC

InChI

InChI=1S/C27H27N3O4/c1-19-17-29(14-15-30(19)26(31)18-33-20-8-4-3-5-9-20)27-22-16-21(32-2)12-13-24(22)34-25-11-7-6-10-23(25)28-27/h3-13,16,19H,14-15,17-18H2,1-2H3