2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]propanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]propanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]propanamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[(2-fluorophenyl)methyl]propanamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]propanamide Traditional Name: N-(2-fluorobenzyl)-2-(4-piperonylpiperazino)propionamide Formula: C22H26FN3O3 MolecularWeight: 399.458543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1F)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1F)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26FN3O3/c1-16(22(27)24-13-18-4-2-3-5-19(18)23)26-10-8-25(9-11-26)14-17-6-7-20-21(12-17)29-15-28-20/h2-7,12,16H,8-11,13-15H2,1H3,(H,24,27)