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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

InChI

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