4-[(3,4-dimethoxyphenyl)methyl]-N-[(2-fluorophenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-N-[(2-fluorophenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-N-[(2-fluorophenyl)methyl]piperazine-1-carboxamide CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-N-[(2-fluorophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-N-[(2-fluorophenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(2-fluorobenzyl)-4-veratryl-piperazine-1-carboxamide Formula: C21H26FN3O3 MolecularWeight: 387.447843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)NCC3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)NCC3=CC=CC=C3F)OC

InChI

InChI=1S/C21H26FN3O3/c1-27-19-8-7-16(13-20(19)28-2)15-24-9-11-25(12-10-24)21(26)23-14-17-5-3-4-6-18(17)22/h3-8,13H,9-12,14-15H2,1-2H3,(H,23,26)