2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone Traditional Name: 1-(4-acetylpiperazino)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C17H21ClN2O4/c1-12(21)19-3-5-20(6-4-19)16(22)11-13-9-14(18)17-15(10-13)23-7-2-8-24-17/h9-10H,2-8,11H2,1H3