1-[4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]ethanone Formula: C22H23FN2O2 MolecularWeight: 366.428623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F

Isomeric SMILES

CC(=O)N1CCCN(CC1)CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C22H23FN2O2/c1-16(26)25-9-3-8-24(10-11-25)15-21-14-19-12-18(6-7-22(19)27-21)17-4-2-5-20(23)13-17/h2,4-7,12-14H,3,8-11,15H2,1H3