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

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-1-(2-hydroxyethylamino)ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-(3,4-diethoxyphenyl)-1-(2-hydroxyethylamino)ethylidene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-(3,4-diethoxyphenyl)-1-(2-hydroxyethylamino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-1-(2-hydroxyethylamino)ethylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(3,4-diethoxyphenyl)-1-(2-hydroxyethylamino)ethylidene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C22H31NO5 MolecularWeight: 389.48524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31NO5/c1-5-27-19-8-7-15(12-20(19)28-6-2)11-16(23-9-10-24)21-17(25)13-22(3,4)14-18(21)26/h7-8,12,23-24H,5-6,9-11,13-14H2,1-4H3