3-[1-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]ethylamino]azepan-2-one

Systemtic Name: 3-[1-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]ethylamino]azepan-2-one Openeye Name: 3-[1-(2,4-dichloro-5-fluoro-phenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(2,4-dichloro-5-fluorophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(2,4-dichloro-5-fluorophenyl)ethylamino]azepan-2-one Traditional Name: 3-[1-(2,4-dichloro-5-fluoro-phenyl)ethylamino]azepan-2-one Formula: C14H17Cl2FN2O MolecularWeight: 319.201983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1Cl)Cl)F)NC2CCCCNC2=O

Isomeric SMILES

CC(C1=CC(=C(C=C1Cl)Cl)F)NC2CCCCNC2=O

InChI

InChI=1S/C14H17Cl2FN2O/c1-8(9-6-12(17)11(16)7-10(9)15)19-13-4-2-3-5-18-14(13)20/h6-8,13,19H,2-5H2,1H3,(H,18,20)