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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)S(=O)C2=CC(=C(C=C2)Cl)F

Isomeric SMILES

C1CCNC(=O)C(C1)S(=O)C2=CC(=C(C=C2)Cl)F

InChI

InChI=1S/C12H13ClFNO2S/c13-9-5-4-8(7-10(9)14)18(17)11-3-1-2-6-15-12(11)16/h4-5,7,11H,1-3,6H2,(H,15,16)