2-[2-(3,4-diethoxyphenyl)-1-pyrrolidin-1-yl-ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-1-pyrrolidin-1-yl-ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-(3,4-diethoxyphenyl)-1-pyrrolidin-1-yl-ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-(3,4-diethoxyphenyl)-1-(1-pyrrolidinyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-1-pyrrolidin-1-ylethylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(3,4-diethoxyphenyl)-1-pyrrolidino-ethylidene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C24H33NO4 MolecularWeight: 399.52312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=C2C(=O)CC(CC2=O)(C)C)N3CCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=C2C(=O)CC(CC2=O)(C)C)N3CCCC3)OCC

InChI

InChI=1S/C24H33NO4/c1-5-28-21-10-9-17(14-22(21)29-6-2)13-18(25-11-7-8-12-25)23-19(26)15-24(3,4)16-20(23)27/h9-10,14H,5-8,11-13,15-16H2,1-4H3