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

Systemtic Name: 1-cyclohexyl-4-(oxolan-2-ylcarbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-6-(3-pyridylmethoxy)-4-(tetrahydrofuran-2-carbonyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[oxo(2-oxolanyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(oxolane-2-carbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-6-(3-pyridylmethoxy)-4-(tetrahydrofuran-2-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)C3CCCO3)OCC4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3CCCO3)OCC4=CN=CC=C4

InChI

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