(3E,5E)-3,5-bis[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1-methyl-piperidin-4-one

Systemtic Name: (3E,5E)-3,5-bis[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1-methyl-piperidin-4-one Openeye Name: (3E,5E)-3,5-bis[(3-chloro-4-hydroxy-5-methoxy-phenyl)methylene]-1-methyl-piperidin-4-one CAS Name: (3E,5E)-3,5-bis[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-methyl-4-piperidinone IUPAC Name: (3E,5E)-3,5-bis[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-methylpiperidin-4-one Traditional Name: (3E,5E)-3,5-bis(3-chloro-4-hydroxy-5-methoxy-benzylidene)-1-methyl-4-piperidone Formula: C22H21Cl2NO5 MolecularWeight: 450.31184

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=CC2=CC(=C(C(=C2)Cl)O)OC)C(=O)C(=CC3=CC(=C(C(=C3)Cl)O)OC)C1

Isomeric SMILES

CN1C/C(=C\C2=CC(=C(C(=C2)Cl)O)OC)/C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)O)OC)/C1

InChI

InChI=1S/C22H21Cl2NO5/c1-25-10-14(4-12-6-16(23)21(27)18(8-12)29-2)20(26)15(11-25)5-13-7-17(24)22(28)19(9-13)30-3/h4-9,27-28H,10-11H2,1-3H3/b14-4+,15-5+