2-[1-[2-(3,4-dimethoxyphenyl)ethylamino]ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethylamino]ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethylamino]ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethylamino]ethylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethylamino]ethylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[1-(homoveratrylamino)ethylidene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)CC(CC1=O)(C)C)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=C1C(=O)CC(CC1=O)(C)C)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H27NO4/c1-13(19-15(22)11-20(2,3)12-16(19)23)21-9-8-14-6-7-17(24-4)18(10-14)25-5/h6-7,10,21H,8-9,11-12H2,1-5H3