1-(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-2-cyclopentyl-ethanone

Systemtic Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-2-cyclopentyl-ethanone Openeye Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-2-cyclopentyl-ethanone CAS Name: 1-[4-(6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-2-cyclopentylethanone IUPAC Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-2-methylpiperazin-1-yl)-2-cyclopentylethanone Traditional Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazino)-2-cyclopentyl-ethanone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC2CCCC2)C3=NC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

CC1CN(CCN1C(=O)CC2CCCC2)C3=NC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C25H29N3O2/c1-18-17-27(14-15-28(18)24(29)16-19-8-2-3-9-19)25-20-10-4-6-12-22(20)30-23-13-7-5-11-21(23)26-25/h4-7,10-13,18-19H,2-3,8-9,14-17H2,1H3