4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-6-oxidanyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-6-oxidanyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-[[5-(2-chlorophenyl)-2-furyl]methyl]-6-hydroxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[[5-(2-chlorophenyl)-2-furanyl]methyl]-6-hydroxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-6-hydroxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 4-[[5-(2-chlorophenyl)-2-furyl]methyl]-6-hydroxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1CC2=CC=C(O2)C3=CC=CC=C3Cl)CC4=CN=CC=C4)O

Isomeric SMILES

C1C(CN(C(=O)CN1CC2=CC=C(O2)C3=CC=CC=C3Cl)CC4=CN=CC=C4)O

InChI

InChI=1S/C22H22ClN3O3/c23-20-6-2-1-5-19(20)21-8-7-18(29-21)14-25-12-17(27)13-26(22(28)15-25)11-16-4-3-9-24-10-16/h1-10,17,27H,11-15H2