1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-ethanoylphenoxy)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-ethanoylphenoxy)ethanone Openeye Name: 2-(4-acetylphenoxy)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(4-acetylphenoxy)-1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetylphenoxy)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-acetylphenoxy)-1-(4-piperonylpiperazino)ethanone Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24N2O5/c1-16(25)18-3-5-19(6-4-18)27-14-22(26)24-10-8-23(9-11-24)13-17-2-7-20-21(12-17)29-15-28-20/h2-7,12H,8-11,13-15H2,1H3