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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2CCCCC2)C3=NC4=CC=CC=C4OC5=C3C=CC(=C5)OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2CCCCC2)C3=NC4=CC=CC=C4OC5=C3C=CC(=C5)OC

InChI

InChI=1S/C26H31N3O3/c1-18-17-28(14-15-29(18)26(30)19-8-4-3-5-9-19)25-21-13-12-20(31-2)16-24(21)32-23-11-7-6-10-22(23)27-25/h6-7,10-13,16,18-19H,3-5,8-9,14-15,17H2,1-2H3