1-(azepan-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone Openeye Name: 1-(azepan-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(2,4,5-trichlorophenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone Formula: C14H16Cl3NO2 MolecularWeight: 336.64134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C14H16Cl3NO2/c15-10-7-12(17)13(8-11(10)16)20-9-14(19)18-5-3-1-2-4-6-18/h7-8H,1-6,9H2