6-[[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-(5-fluoro-2-methoxy-benzyl)piperazino]methyl]sesamol Formula: C20H23FN2O4 MolecularWeight: 374.406023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CN2CCN(CC2)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)F)CN2CCN(CC2)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C20H23FN2O4/c1-25-18-3-2-16(21)8-15(18)12-23-6-4-22(5-7-23)11-14-9-19-20(10-17(14)24)27-13-26-19/h2-3,8-10,24H,4-7,11-13H2,1H3