1-[4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)piperazino]-2-methyl-propan-1-one Formula: C18H23ClN2O4 MolecularWeight: 366.83922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN2O4/c1-12(2)17(22)20-4-6-21(7-5-20)18(23)13-10-14(19)16-15(11-13)24-8-3-9-25-16/h10-12H,3-9H2,1-2H3