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

Systemtic Name: 2-[1,3-benzodioxol-5-yl-[(4-methylphenyl)amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[1,3-benzodioxol-5-yl-(4-methylanilino)methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1,3-benzodioxol-5-yl-(4-methylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[1,3-benzodioxol-5-yl-(4-methylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[1,3-benzodioxol-5-yl(p-toluidino)methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C2C(=O)CC(CC2=O)(C)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=C2C(=O)CC(CC2=O)(C)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H23NO4/c1-14-4-7-16(8-5-14)24-22(15-6-9-19-20(10-15)28-13-27-19)21-17(25)11-23(2,3)12-18(21)26/h4-10,24H,11-13H2,1-3H3