1-cyclohexyl-4-(oxolan-3-ylcarbonyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(oxolan-3-ylcarbonyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-6-(2-pyridylmethoxy)-4-(tetrahydrofuran-3-carbonyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[oxo(3-oxolanyl)methyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(oxolane-3-carbonyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-6-(2-pyridylmethoxy)-4-(tetrahydrofuran-3-carbonyl)-1,4-diazepan-2-one Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3CCOC3)OCC4=CC=CC=N4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3CCOC3)OCC4=CC=CC=N4

InChI

InChI=1S/C22H31N3O4/c26-21-14-24(22(27)17-9-11-28-15-17)12-20(29-16-18-6-4-5-10-23-18)13-25(21)19-7-2-1-3-8-19/h4-6,10,17,19-20H,1-3,7-9,11-16H2