methyl 2-[4-(4-benzamido-2-fluoranyl-phenyl)piperazin-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-(4-benzamido-2-fluoranyl-phenyl)piperazin-1-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-(4-benzamido-2-fluoro-phenyl)piperazin-1-yl]-2-phenyl-acetate CAS Name: 2-[4-(4-benzamido-2-fluorophenyl)-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-(4-benzamido-2-fluorophenyl)piperazin-1-yl]-2-phenylacetate Traditional Name: 2-[4-(4-benzamido-2-fluoro-phenyl)piperazino]-2-phenyl-acetic acid methyl ester Formula: C26H26FN3O3 MolecularWeight: 447.501343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)F

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C26H26FN3O3/c1-33-26(32)24(19-8-4-2-5-9-19)30-16-14-29(15-17-30)23-13-12-21(18-22(23)27)28-25(31)20-10-6-3-7-11-20/h2-13,18,24H,14-17H2,1H3,(H,28,31)