4-(1-benzofuran-2-ylcarbonyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1-benzofuran-2-ylcarbonyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(benzofuran-2-carbonyl)-1-cyclohexyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[2-benzofuranyl(oxo)methyl]-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1-benzofuran-2-carbonyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(benzofuran-2-carbonyl)-1-cyclohexyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4O3)OCC5=CC=NC=C5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4O3)OCC5=CC=NC=C5

InChI

InChI=1S/C26H29N3O4/c30-25-17-28(26(31)24-14-20-6-4-5-9-23(20)33-24)15-22(32-18-19-10-12-27-13-11-19)16-29(25)21-7-2-1-3-8-21/h4-6,9-14,21-22H,1-3,7-8,15-18H2