N-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide Traditional Name: 3-[[4-(4-fluorophenyl)piperazino]methyl]-N-piperonyl-benzamide Formula: C26H26FN3O3 MolecularWeight: 447.501343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H26FN3O3/c27-22-5-7-23(8-6-22)30-12-10-29(11-13-30)17-20-2-1-3-21(14-20)26(31)28-16-19-4-9-24-25(15-19)33-18-32-24/h1-9,14-15H,10-13,16-18H2,(H,28,31)