1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone

Systemtic Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone Openeye Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone CAS Name: 1-[4-(2-fluorophenyl)-1-piperazinyl]-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]ethanone IUPAC Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]ethanone Traditional Name: 1-[4-(2-fluorophenyl)piperazino]-2-[(2-methoxy-5-methyl-benzyl)-methyl-amino]ethanone Formula: C22H28FN3O2 MolecularWeight: 385.475023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C22H28FN3O2/c1-17-8-9-21(28-3)18(14-17)15-24(2)16-22(27)26-12-10-25(11-13-26)20-7-5-4-6-19(20)23/h4-9,14H,10-13,15-16H2,1-3H3