2-(4-fluorophenyl)-1-[4-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-fluorophenyl)-1-[4-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-fluorophenyl)-1-[4-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-fluorophenyl)-1-[4-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-fluorophenyl)-1-[4-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-fluorophenyl)-1-[4-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]piperazino]ethanone Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)C(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)C(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN2O4/c21-16-3-1-14(2-4-16)9-20(25)23-7-5-22(6-8-23)12-15-10-18-19(11-17(15)24)27-13-26-18/h1-4,10-11,24H,5-9,12-13H2