1-(1,3-benzodioxol-5-ylmethyl)-4-[[3-(2-fluorophenyl)-1-methyl-pyrazol-4-yl]methyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[3-(2-fluorophenyl)-1-methyl-pyrazol-4-yl]methyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[3-(2-fluorophenyl)-1-methyl-pyrazol-4-yl]methyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[3-(2-fluorophenyl)-1-methyl-4-pyrazolyl]methyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[3-(2-fluorophenyl)-1-methylpyrazol-4-yl]methyl]piperazine Traditional Name: 1-[[3-(2-fluorophenyl)-1-methyl-pyrazol-4-yl]methyl]-4-piperonyl-piperazine Formula: C23H25FN4O2 MolecularWeight: 408.468603

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2F)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2F)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H25FN4O2/c1-26-14-18(23(25-26)19-4-2-3-5-20(19)24)15-28-10-8-27(9-11-28)13-17-6-7-21-22(12-17)30-16-29-21/h2-7,12,14H,8-11,13,15-16H2,1H3