2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C22H25NO2 MolecularWeight: 335.4394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)CC(CC3=O)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)CC(CC3=O)(C)C)C

InChI

InChI=1S/C22H25NO2/c1-14-6-8-18(9-7-14)23-15(2)10-17(16(23)3)11-19-20(24)12-22(4,5)13-21(19)25/h6-11H,12-13H2,1-5H3