1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-(10-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]-2-phenyl-ethanone Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC2=CC=CC=C2)C3=NC4=CC=CC=C4OC5=C3C=CC=C5OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC2=CC=CC=C2)C3=NC4=CC=CC=C4OC5=C3C=CC=C5OC

InChI

InChI=1S/C27H27N3O3/c1-19-18-29(15-16-30(19)25(31)17-20-9-4-3-5-10-20)27-21-11-8-14-24(32-2)26(21)33-23-13-7-6-12-22(23)28-27/h3-14,19H,15-18H2,1-2H3