4-(4-chloranyl-3-fluoranyl-phenyl)sulfinylazepan-2-one

Systemtic Name: 4-(4-chloranyl-3-fluoranyl-phenyl)sulfinylazepan-2-one Openeye Name: 4-(4-chloro-3-fluoro-phenyl)sulfinylazepan-2-one CAS Name: 4-(4-chloro-3-fluorophenyl)sulfinyl-2-azepanone IUPAC Name: 4-(4-chloro-3-fluorophenyl)sulfinylazepan-2-one Traditional Name: 4-(4-chloro-3-fluoro-phenyl)sulfinylazepan-2-one Formula: C12H13ClFNO2S MolecularWeight: 289.753523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(=O)NC1)S(=O)C2=CC(=C(C=C2)Cl)F

Isomeric SMILES

C1CC(CC(=O)NC1)S(=O)C2=CC(=C(C=C2)Cl)F

InChI

InChI=1S/C12H13ClFNO2S/c13-10-4-3-9(6-11(10)14)18(17)8-2-1-5-15-12(16)7-8/h3-4,6,8H,1-2,5,7H2,(H,15,16)