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

Systemtic Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3-propoxy-benzamide Openeye Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3-propoxy-benzamide CAS Name: N-[4-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]phenyl]-3-propoxybenzamide IUPAC Name: N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-3-propoxybenzamide Traditional Name: N-[4-[4-(2-fluorobenzyl)piperazino]phenyl]-3-propoxy-benzamide Formula: C27H30FN3O2 MolecularWeight: 447.544403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4F

InChI

InChI=1S/C27H30FN3O2/c1-2-18-33-25-8-5-7-21(19-25)27(32)29-23-10-12-24(13-11-23)31-16-14-30(15-17-31)20-22-6-3-4-9-26(22)28/h3-13,19H,2,14-18,20H2,1H3,(H,29,32)