1-(4-benzo[b][1,4]benzoxazepin-6-yl-1,4-diazepan-1-yl)-3-methyl-butan-1-one

Systemtic Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-1,4-diazepan-1-yl)-3-methyl-butan-1-one Openeye Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-1,4-diazepan-1-yl)-3-methyl-butan-1-one CAS Name: 1-[4-(6-benzo[b][1,4]benzoxazepinyl)-1,4-diazepan-1-yl]-3-methyl-1-butanone IUPAC Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-1,4-diazepan-1-yl)-3-methylbutan-1-one Traditional Name: 1-(4-benzo[b][1,4]benzoxazepin-6-yl-1,4-diazepan-1-yl)-3-methyl-butan-1-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

CC(C)CC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C23H27N3O2/c1-17(2)16-22(27)25-12-7-13-26(15-14-25)23-18-8-3-5-10-20(18)28-21-11-6-4-9-19(21)24-23/h3-6,8-11,17H,7,12-16H2,1-2H3