3-[2,4,5-tris(chloranyl)phenoxy]azepan-2-one

Systemtic Name: 3-[2,4,5-tris(chloranyl)phenoxy]azepan-2-one Openeye Name: 3-(2,4,5-trichlorophenoxy)azepan-2-one CAS Name: 3-(2,4,5-trichlorophenoxy)-2-azepanone IUPAC Name: 3-(2,4,5-trichlorophenoxy)azepan-2-one Traditional Name: 3-(2,4,5-trichlorophenoxy)azepan-2-one Formula: C12H12Cl3NO2 MolecularWeight: 308.58818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)OC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C12H12Cl3NO2/c13-7-5-9(15)11(6-8(7)14)18-10-3-1-2-4-16-12(10)17/h5-6,10H,1-4H2,(H,16,17)