cyclohexyl-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]methanone

Systemtic Name: cyclohexyl-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]methanone Openeye Name: cyclohexyl-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]methanone CAS Name: cyclohexyl-[4-(9-methoxy-2-methyl-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[4-(9-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]methanone Traditional Name: cyclohexyl-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazino]methanone Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C3=C(O2)C=C(C=C3)OC)N4CCN(CC4)C(=O)C5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C3=C(O2)C=C(C=C3)OC)N4CCN(CC4)C(=O)C5CCCCC5

InChI

InChI=1S/C26H31N3O3/c1-18-8-11-22-24(16-18)32-23-17-20(31-2)9-10-21(23)25(27-22)28-12-14-29(15-13-28)26(30)19-6-4-3-5-7-19/h8-11,16-17,19H,3-7,12-15H2,1-2H3