[2-acetyloxy-3-[4-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)piperazin-1-yl]propyl] ethanoate

Systemtic Name: [2-acetyloxy-3-[4-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)piperazin-1-yl]propyl] ethanoate Openeye Name: [2-acetoxy-3-[4-(7-oxocyclohepta-1,3,5-trien-1-yl)piperazin-1-yl]propyl] acetate CAS Name: acetic acid [2-acetyloxy-3-[4-(7-oxo-1-cyclohepta-1,3,5-trienyl)-1-piperazinyl]propyl] ester IUPAC Name: [2-acetyloxy-3-[4-(7-oxocyclohepta-1,3,5-trien-1-yl)piperazin-1-yl]propyl] acetate Traditional Name: acetic acid [2-acetoxy-3-[4-(7-ketocyclohepta-1,3,5-trien-1-yl)piperazino]propyl] ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CN1CCN(CC1)C2=CC=CC=CC2=O)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CN1CCN(CC1)C2=CC=CC=CC2=O)OC(=O)C

InChI

InChI=1S/C18H24N2O5/c1-14(21)24-13-16(25-15(2)22)12-19-8-10-20(11-9-19)17-6-4-3-5-7-18(17)23/h3-7,16H,8-13H2,1-2H3