4-[3,5-bis(chloranyl)phenyl]sulfonylazepan-2-one

Systemtic Name: 4-[3,5-bis(chloranyl)phenyl]sulfonylazepan-2-one Openeye Name: 4-(3,5-dichlorophenyl)sulfonylazepan-2-one CAS Name: 4-(3,5-dichlorophenyl)sulfonyl-2-azepanone IUPAC Name: 4-(3,5-dichlorophenyl)sulfonylazepan-2-one Traditional Name: 4-(3,5-dichlorophenyl)sulfonylazepan-2-one Formula: C12H13Cl2NO3S MolecularWeight: 322.20752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13Cl2NO3S/c13-8-4-9(14)6-11(5-8)19(17,18)10-2-1-3-15-12(16)7-10/h4-6,10H,1-3,7H2,(H,15,16)