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

Systemtic Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]ethanone CAS Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]ethanone IUPAC Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)piperazino]ethanone 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)CC5CCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C3=C(O2)C=C(C=C3)OC)N4CCN(CC4)C(=O)CC5CCCC5

InChI

InChI=1S/C26H31N3O3/c1-18-7-10-22-24(15-18)32-23-17-20(31-2)8-9-21(23)26(27-22)29-13-11-28(12-14-29)25(30)16-19-5-3-4-6-19/h7-10,15,17,19H,3-6,11-14,16H2,1-2H3