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

Systemtic Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]ethanone CAS Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]ethanone IUPAC Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-[4-(9-methoxy-2-methyl-benzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]ethanone Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC2CCCC2)C3=NC4=C(C=C(C=C4)C)OC5=C3C=CC(=C5)OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC2CCCC2)C3=NC4=C(C=C(C=C4)C)OC5=C3C=CC(=C5)OC

InChI

InChI=1S/C27H33N3O3/c1-18-8-11-23-25(14-18)33-24-16-21(32-3)9-10-22(24)27(28-23)29-12-13-30(19(2)17-29)26(31)15-20-6-4-5-7-20/h8-11,14,16,19-20H,4-7,12-13,15,17H2,1-3H3