3-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]azepan-2-one

Systemtic Name: 3-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]azepan-2-one Openeye Name: 3-(5-chloro-2,4-dimethoxy-anilino)azepan-2-one CAS Name: 3-(5-chloro-2,4-dimethoxyanilino)-2-azepanone IUPAC Name: 3-(5-chloro-2,4-dimethoxyanilino)azepan-2-one Traditional Name: 3-(5-chloro-2,4-dimethoxy-anilino)azepan-2-one Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2CCCCNC2=O)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2CCCCNC2=O)Cl)OC

InChI

InChI=1S/C14H19ClN2O3/c1-19-12-8-13(20-2)11(7-9(12)15)17-10-5-3-4-6-16-14(10)18/h7-8,10,17H,3-6H2,1-2H3,(H,16,18)