N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[4-(2-fluorobenzyl)piperazino]phenyl]-3,4-dimethoxy-benzamide Formula: C26H28FN3O3 MolecularWeight: 449.517223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F)OC

InChI

InChI=1S/C26H28FN3O3/c1-32-24-12-7-19(17-25(24)33-2)26(31)28-21-8-10-22(11-9-21)30-15-13-29(14-16-30)18-20-5-3-4-6-23(20)27/h3-12,17H,13-16,18H2,1-2H3,(H,28,31)