4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-N-(2-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)piperazine-1-carboxamide Formula: C27H26FN3O3 MolecularWeight: 459.512043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C27H26FN3O3/c1-33-26-8-3-2-7-24(26)29-27(32)31-13-11-30(12-14-31)18-23-17-21-15-20(9-10-25(21)34-23)19-5-4-6-22(28)16-19/h2-10,15-17H,11-14,18H2,1H3,(H,29,32)