3-[2,5-bis(chloranyl)phenoxy]azepan-2-one

Systemtic Name: 3-[2,5-bis(chloranyl)phenoxy]azepan-2-one Openeye Name: 3-(2,5-dichlorophenoxy)azepan-2-one CAS Name: 3-(2,5-dichlorophenoxy)-2-azepanone IUPAC Name: 3-(2,5-dichlorophenoxy)azepan-2-one Traditional Name: 3-(2,5-dichlorophenoxy)azepan-2-one Formula: C12H13Cl2NO2 MolecularWeight: 274.14312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)OC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H13Cl2NO2/c13-8-4-5-9(14)11(7-8)17-10-3-1-2-6-15-12(10)16/h4-5,7,10H,1-3,6H2,(H,15,16)