3-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 3-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]butan-1-one CAS Name: 3-methyl-1-[4-(8-methyl-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-1-butanone IUPAC Name: 3-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[4-(8-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazino]butan-1-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)CC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)CC(C)C

InChI

InChI=1S/C23H27N3O2/c1-16(2)14-22(27)25-10-12-26(13-11-25)23-18-15-17(3)8-9-20(18)28-21-7-5-4-6-19(21)24-23/h4-9,15-16H,10-14H2,1-3H3