4-(5-chloranyl-2-fluoranyl-phenyl)carbonyl-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(5-chloranyl-2-fluoranyl-phenyl)carbonyl-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(5-chloro-2-fluoro-benzoyl)-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-(4-oxanylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(5-chloro-2-fluorobenzoyl)-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(5-chloro-2-fluoro-benzoyl)-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C24H27ClFN3O4 MolecularWeight: 475.940283

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=C(C=CC(=C3)Cl)F)OCC4=CC=NC=C4

Isomeric SMILES

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=C(C=CC(=C3)Cl)F)OCC4=CC=NC=C4

InChI

InChI=1S/C24H27ClFN3O4/c25-19-1-2-22(26)21(11-19)24(31)29-14-20(33-16-18-3-7-27-8-4-18)13-28(23(30)15-29)12-17-5-9-32-10-6-17/h1-4,7-8,11,17,20H,5-6,9-10,12-16H2